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<article article-type="research-article" xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:xlink="http://www.w3.org/1999/xlink" xmlns:oasis="http://www.niso.org/standards/z39-96/ns/oasis-exchange/table"><front><journal-meta><journal-id journal-id-type="publisher-id">PRD</journal-id><journal-id journal-id-type="coden">PRVDAQ</journal-id><journal-title-group><journal-title>Physical Review D</journal-title><abbrev-journal-title>Phys. Rev. D</abbrev-journal-title></journal-title-group><issn pub-type="ppub">2470-0010</issn><issn pub-type="epub">2470-0029</issn><publisher><publisher-name>American Physical Society</publisher-name></publisher></journal-meta><article-meta><article-id pub-id-type="doi">10.1103/PhysRevD.100.063017</article-id><article-categories><subj-group subj-group-type="toc-major"><subject>ARTICLES</subject></subj-group><subj-group subj-group-type="toc-minor"><subject>Astrophysics and astroparticle physics</subject></subj-group></article-categories><title-group><article-title>Electron-interacting dark matter: Implications from DAMA/LIBRA-phase2 and prospects for liquid xenon detectors and NaI detectors</article-title><alt-title alt-title-type="running-title">ELECTRON-INTERACTING DARK MATTER: IMPLICATIONS …</alt-title><alt-title alt-title-type="running-author">ROBERTS B. M. AND FLAMBAUM V. V.</alt-title></title-group><contrib-group><contrib contrib-type="author"><contrib-id contrib-id-type="orcid">https://orcid.org/0000-0002-0345-6375</contrib-id><name><surname>Roberts</surname><given-names>B. M.</given-names></name><xref ref-type="aff" rid="a1 a2"><sup>1,2</sup></xref><xref ref-type="author-notes" rid="n1"><sup>,*</sup></xref></contrib><contrib contrib-type="author"><name><surname>Flambaum</surname><given-names>V. V.</given-names></name><xref ref-type="aff" rid="a3 a4"><sup>3,4</sup></xref></contrib><aff id="a1"><label><sup>1</sup></label>SYRTE, Observatoire de Paris, <institution>Université PSL</institution>, CNRS, Sorbonne Université, LNE, 61 avenue de l’Observatoire 75014 Paris, France</aff><aff id="a2"><label><sup>2</sup></label>School of Mathematics and Physics, <institution>The University of Queensland</institution>, Brisbane QLD 4072, Australia</aff><aff id="a3"><label><sup>3</sup></label>School of Physics, <institution>University of New South Wales</institution>, Sydney 2052, Australia</aff><aff id="a4"><label><sup>4</sup></label><institution>Johannes Gutenberg-Universität Mainz</institution>, 55099 Mainz, Germany</aff></contrib-group><author-notes><fn id="n1"><label><sup>*</sup></label><p><email>b.roberts@uq.edu.au</email></p></fn></author-notes><pub-date iso-8601-date="2019-09-30" date-type="pub" publication-format="electronic"><day>30</day><month>September</month><year>2019</year></pub-date><pub-date iso-8601-date="2019-09-15" date-type="pub" publication-format="print"><day>15</day><month>September</month><year>2019</year></pub-date><volume>100</volume><issue>6</issue><elocation-id>063017</elocation-id><pub-history><event><date iso-8601-date="2019-04-15" date-type="received"><day>15</day><month>April</month><year>2019</year></date></event></pub-history><permissions><copyright-statement>Published by the American Physical Society</copyright-statement><copyright-year>2019</copyright-year><copyright-holder>authors</copyright-holder><license license-type="creative-commons" xlink:href="https://creativecommons.org/licenses/by/4.0/"><license-p content-type="usage-statement">Published by the American Physical Society under the terms of the <ext-link ext-link-type="uri" xlink:href="https://creativecommons.org/licenses/by/4.0/">Creative Commons Attribution 4.0 International</ext-link> license. Further distribution of this work must maintain attribution to the author(s) and the published article’s title, journal citation, and DOI. Funded by SCOAP<sup>3</sup>.</license-p></license></permissions><abstract><p>We investigate the possibility for the direct detection of low-mass (GeV scale) weakly interacting massive particles (WIMP) dark matter in scintillation experiments. Such WIMPs are typically too light to leave appreciable nuclear recoils but may be detected via their scattering off atomic electrons. In particular, the DAMA Collaboration [R. Bernabei <italic>et al.</italic>, <mixed-citation publication-type="journal"><source>Nucl. Phys. At. Energy</source> <volume>19</volume>, <page-range>307</page-range> (<year>2018</year>)<pub-id pub-id-type="doi" specific-use="suppress-display">10.15407/jnpae2018.04.307</pub-id></mixed-citation>] has recently presented strong evidence of an annual modulation in the scintillation rate observed at energies as low as 1 keV. Despite a strong enhancement in the calculated event rate at low energies, we find that an interpretation in terms of electron-interacting WIMPs cannot be consistent with existing constraints. We also demonstrate the importance of correct treatment of the atomic wave functions and show the resulting event rate is very sensitive to the low-energy performance of the detectors, meaning it is crucial that the detector uncertainties be taken into account. Finally, we demonstrate that the potential scintillation event rate can be much larger than may otherwise be expected, meaning that competitive searches can be performed for <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:mo>∼</mml:mo><mml:mi>GeV</mml:mi></mml:mrow></mml:math></inline-formula> scale WIMPs using the conventional prompt (<inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>1</mml:mn></mml:math></inline-formula>) scintillation signals. This is important given the recent and upcoming very large liquid xenon detectors.</p></abstract><funding-group><award-group award-type="unspecified"><funding-source country="AU"><institution-wrap><institution>Australian Research Council</institution><institution-id institution-id-type="doi" vocab="open-funder-registry" vocab-identifier="10.13039/open-funder-registry">10.13039/501100000923</institution-id></institution-wrap></funding-source></award-group><award-group award-type="unspecified"><funding-source country="DE"><institution-wrap><institution>Gutenberg Forschungskolleg</institution><institution-id institution-id-type="doi" vocab="open-funder-registry" vocab-identifier="10.13039/open-funder-registry">10.13039/501100004812</institution-id></institution-wrap></funding-source></award-group></funding-group><counts><page-count count="11"/></counts></article-meta></front><body><sec id="s1"><label>I.</label><title>INTRODUCTION</title><p>The identity and nature of dark matter (DM) remains one of the most important outstanding problems in modern physics. Despite the overwhelming astrophysical evidence for its existence, no conclusive terrestrial observation of DM has yet been reported <xref ref-type="bibr" rid="c1 c2">[1,2]</xref>. Currently, most of the effort in the search for DM has focused on weakly interacting massive particles (WIMPs) with masses <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:mo>≳</mml:mo><mml:mn>10</mml:mn><mml:mi>–</mml:mi><mml:mn>100</mml:mn><mml:mtext> </mml:mtext><mml:mi>GeV</mml:mi></mml:mrow></mml:math></inline-formula> through their hypothesized nongravitational interactions with Standard Model particles. In this work, we consider low-mass WIMP DM with masses on the order of 1 GeV.</p><p>One long-standing claim of a potential DM detection was made by the DAMA Collaboration, which uses a NaI-based scintillation detector to search for possible DM interactions within the crystal in the underground laboratory at the Gran Sasso National Laboratory, Istituto Nazionale di Fisica Nucleare (INFN), Italy <xref ref-type="bibr" rid="c3">[3]</xref> (see also Refs. <xref ref-type="bibr" rid="c4 c5">[4,5]</xref>). The results from the combination of the DAMA/LIBRA and DAMA/NaI experiments indicated an annual modulation in the event rate at around 3 keV electron-equivalent energy deposition (with a low-energy threshold of approximately 2 keV) with a <inline-formula><mml:math display="inline"><mml:mrow><mml:mn>9.3</mml:mn><mml:mi>σ</mml:mi></mml:mrow></mml:math></inline-formula> significance <xref ref-type="bibr" rid="c3">[3]</xref>. The phase of this modulation agrees very well with the assumption that the signal is due to the scattering of WIMP DM present in the galactic halo. An annual modulation in the observed WIMP scattering event rate is expected due to the motion of the Earth around the Sun, which results in an annual variation of the DM flux through a detector (and the mean DM kinetic energy); see, e.g., Refs. <xref ref-type="bibr" rid="c6 c7">[6,7]</xref>.</p><p>Despite the significant signal, there is strong doubt that the DAMA Collaboration result can be due to WIMPs, since it is seemingly in conflict with the null results of many other direct detection experiments, e.g., Refs. <xref ref-type="bibr" rid="c8 c9 c10 c11 c12">[8–12]</xref>. There are also several works which offer explanations the DAMA result in terms of non-DM origins, e.g., in Ref. <xref ref-type="bibr" rid="c13">[13]</xref>. However, it is not always possible to compare different experiments in a model-independent way, meaning it is difficult to make general statements to this effect.</p><p>For example, one possibility that has been considered in the literature is that the DAMA modulation signal may be caused by WIMPs that scatter off the atomic electrons <xref ref-type="bibr" rid="c14 c15 c16">[14–16]</xref>, as opposed to nuclear scattering as is assumed in typical experiments. This is particularly applicable for lighter WIMPs (<inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:mo>≲</mml:mo><mml:mn>10</mml:mn><mml:mtext> </mml:mtext><mml:mi>GeV</mml:mi></mml:mrow></mml:math></inline-formula>), which will not leave appreciable nuclear recoils. Most direct detection experiments try to reject pure electron scattering events, in order to perform nuclear recoil searches with as low as possible background. Conversely, the DAMA experiment is sensitive to WIMPs which scatter off either electrons or nuclei, potentially allowing electron-interacting DM to explain the DAMA modulation while avoiding the tight constraints from other experiments. In a recent work <xref ref-type="bibr" rid="c17">[17]</xref>, however, we used scintillation and ionization signals from the XENON100 <xref ref-type="bibr" rid="c18">[18]</xref> and XENON10 <xref ref-type="bibr" rid="c19">[19]</xref> experiments to rule out this possibility for the observed signal above 2 keV; see also Refs. <xref ref-type="bibr" rid="c20 c21 c22">[20–22]</xref>.</p><p>Recently, newer results from the DAMA/LIBRA-phase2 experiment have become available <xref ref-type="bibr" rid="c23">[23]</xref> (see also Refs. <xref ref-type="bibr" rid="c24 c25">[24,25]</xref>). These results strengthen the claim for a detected signal, with the significance of the annual modulation in the 2–6 keV energy window rising to <inline-formula><mml:math display="inline"><mml:mrow><mml:mn>12.9</mml:mn><mml:mi>σ</mml:mi></mml:mrow></mml:math></inline-formula>. Importantly, the low-energy threshold has been lowered in the new experiment to 1 keV, and the annual modulation is also clearly present in this region (<inline-formula><mml:math display="inline"><mml:mrow><mml:mn>9.5</mml:mn><mml:mi>σ</mml:mi></mml:mrow></mml:math></inline-formula> significance). This may be of particular significance for the interpretation in terms of electron-interacting DM. In our previous work <xref ref-type="bibr" rid="c17">[17]</xref>, we showed that there would be an almost exponential increase in the potential event rate at lower energies for such models of light (<inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:mo>∼</mml:mo><mml:mn>1</mml:mn><mml:mtext> </mml:mtext><mml:mi>GeV</mml:mi></mml:mrow></mml:math></inline-formula>) WIMPs.</p><p>For the approximately kilo-electron-volt energy depositions of interest to this work, the relevant process for electron scattering DM is atomic ionization. Such processes are kinematically disfavored at these energy scales, and therefore the scattering probes deep inside the bound-state wave function, with the main contribution coming from the wave function at distances much smaller than the characteristic Bohr radius of an atom. In such a situation, incorrect small-distance scaling of the wave functions (for example, by using an “effective <inline-formula><mml:math display="inline"><mml:mi>Z</mml:mi></mml:math></inline-formula>” model or assuming plane waves for the outgoing ionization electron) can lead to large errors in the predicted ionization rates <xref ref-type="bibr" rid="c17">[17]</xref>. Further, the relativistic effects for the electron wave function are crucial and must be taken into account <xref ref-type="bibr" rid="c26">[26]</xref>. As such, interpretation in terms of light WIMPs requires nontrivial calculations of the atomic structure and ionization rates. Finally, we note that there are several ongoing experiments <xref ref-type="bibr" rid="c27 c28 c29 c30 c31 c32 c33 c34">[27–34]</xref> and proposals <xref ref-type="bibr" rid="c35 c36 c37 c38 c39 c40 c41">[35–41]</xref> to search for light WIMPs in direct detection experiments. We also note that weak evidence for annual modulation at 2 keV from the COSINE Collaboration has been recently made public <xref ref-type="bibr" rid="c42">[42]</xref> (see also Ref. <xref ref-type="bibr" rid="c43">[43]</xref>).</p></sec><sec id="s2"><label>II.</label><title>THEORY</title><sec id="s2a"><label>A.</label><title>Atomic ionization</title><p>Throughout the text and in the figures, we use relativistic units (<inline-formula><mml:math display="inline"><mml:mo>ℏ</mml:mo><mml:mo>=</mml:mo><mml:mi>c</mml:mi><mml:mo>=</mml:mo><mml:mn>1</mml:mn></mml:math></inline-formula>), with masses, energies, and momenta presented in electron-volts, as is standard in the field. However, it is also customary, e.g., to present cross sections in centimeters squared, event rates in counts/kilogram/kilo-electron-volts/day. Further, for the calculations of atomic ionization, it is convenient and common to use atomic units (<inline-formula><mml:math display="inline"><mml:mrow><mml:mo>ℏ</mml:mo><mml:mo>=</mml:mo><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:mn>1</mml:mn><mml:mo>,</mml:mo><mml:mi>c</mml:mi><mml:mo>=</mml:mo><mml:mn>1</mml:mn><mml:mo stretchy="false">/</mml:mo><mml:mi>α</mml:mi></mml:mrow></mml:math></inline-formula>). Therefore, to avoid any possible confusion, we leave all factors <inline-formula><mml:math display="inline"><mml:mrow><mml:mo>ℏ</mml:mo></mml:mrow></mml:math></inline-formula> and <inline-formula><mml:math display="inline"><mml:mi>c</mml:mi></mml:math></inline-formula> in the equations.</p><p>We consider DM particles that have electron interactions of the form <disp-formula id="d1"><mml:math display="block"><mml:mrow><mml:mi>V</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mi mathvariant="bold">r</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mo>=</mml:mo><mml:mo>ℏ</mml:mo><mml:mi>c</mml:mi><mml:msub><mml:mrow><mml:mi>α</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:mfrac><mml:mrow><mml:msup><mml:mrow><mml:mi>e</mml:mi></mml:mrow><mml:mrow><mml:mo>-</mml:mo><mml:mi>μ</mml:mi><mml:mi>r</mml:mi></mml:mrow></mml:msup></mml:mrow><mml:mrow><mml:mi>r</mml:mi></mml:mrow></mml:mfrac><mml:mo>,</mml:mo></mml:mrow></mml:math><label>(1)</label></disp-formula>where <inline-formula><mml:math display="inline"><mml:mi>μ</mml:mi></mml:math></inline-formula> is the inverse of the length scale for the interaction, set by the mediator mass (e.g., <inline-formula><mml:math display="inline"><mml:mi>μ</mml:mi><mml:mo>=</mml:mo><mml:msub><mml:mi>m</mml:mi><mml:mi>v</mml:mi></mml:msub><mml:mi>c</mml:mi><mml:mo stretchy="false">/</mml:mo><mml:mo>ℏ</mml:mo></mml:math></inline-formula>) and <inline-formula><mml:math display="inline"><mml:msub><mml:mi>α</mml:mi><mml:mi>χ</mml:mi></mml:msub></mml:math></inline-formula> is the effective DM-electron coupling strength. Such effective interaction Hamiltonians arise generally in the case of either scalar or vector interactions (e.g., via the exchange of a dark photon). The coefficient in <xref ref-type="disp-formula" rid="d1">(1)</xref> is chosen so that in the case of a massless mediator (long-range interaction, <inline-formula><mml:math display="inline"><mml:mi>μ</mml:mi><mml:mo>=</mml:mo><mml:mn>0</mml:mn></mml:math></inline-formula>), this reduces to a Coulomb(-like) potential (with <inline-formula><mml:math display="inline"><mml:mi>α</mml:mi><mml:mo stretchy="false">→</mml:mo><mml:msub><mml:mi>α</mml:mi><mml:mi>χ</mml:mi></mml:msub></mml:math></inline-formula>). In the limit of a very heavy mediator, the above reduces to the contact interaction: <inline-formula><mml:math display="inline"><mml:mrow><mml:mi>V</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mi mathvariant="bold-italic">r</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mo>=</mml:mo><mml:mn>4</mml:mn><mml:mi>π</mml:mi><mml:mo>ℏ</mml:mo><mml:mi>c</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:msub><mml:mrow><mml:mi>α</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">/</mml:mo><mml:msup><mml:mrow><mml:mi>μ</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:mo stretchy="false">)</mml:mo><mml:mi>δ</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mi mathvariant="bold-italic">r</mml:mi><mml:mo stretchy="false">)</mml:mo></mml:mrow></mml:math></inline-formula>.</p><p>The differential cross section (for fixed velocity <inline-formula><mml:math display="inline"><mml:mi>v</mml:mi></mml:math></inline-formula>) for the excitation of an electron in the initial state <inline-formula><mml:math display="inline"><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:math></inline-formula> is <disp-formula id="d2"><mml:math display="block"><mml:mrow><mml:mfrac><mml:mrow><mml:mi mathvariant="normal">d</mml:mi><mml:msub><mml:mrow><mml:mi>σ</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub></mml:mrow><mml:mrow><mml:mi mathvariant="normal">d</mml:mi><mml:mi>E</mml:mi></mml:mrow></mml:mfrac><mml:mo>=</mml:mo><mml:mn>8</mml:mn><mml:mi>π</mml:mi><mml:msubsup><mml:mrow><mml:mi>α</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msubsup><mml:msup><mml:mrow><mml:mo>(</mml:mo><mml:mfrac><mml:mrow><mml:mi>c</mml:mi></mml:mrow><mml:mrow><mml:mi>v</mml:mi></mml:mrow></mml:mfrac><mml:mo>)</mml:mo></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:msubsup><mml:mrow><mml:mo>∫</mml:mo></mml:mrow><mml:mrow><mml:msub><mml:mrow><mml:mi>q</mml:mi></mml:mrow><mml:mrow><mml:mo>-</mml:mo></mml:mrow></mml:msub></mml:mrow><mml:mrow><mml:msub><mml:mrow><mml:mi>q</mml:mi></mml:mrow><mml:mrow><mml:mo>+</mml:mo></mml:mrow></mml:msub></mml:mrow></mml:msubsup><mml:mfrac><mml:mrow><mml:mi>q</mml:mi><mml:mi mathvariant="normal">d</mml:mi><mml:mi>q</mml:mi></mml:mrow><mml:mrow><mml:mo stretchy="false">(</mml:mo><mml:msup><mml:mrow><mml:mi>q</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:mo>+</mml:mo><mml:msup><mml:mrow><mml:mi>μ</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:msup><mml:mrow><mml:mo stretchy="false">)</mml:mo></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup></mml:mrow></mml:mfrac><mml:mfrac><mml:mrow><mml:msub><mml:mrow><mml:mi>K</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>E</mml:mi><mml:mo>,</mml:mo><mml:mi>q</mml:mi><mml:mo stretchy="false">)</mml:mo></mml:mrow><mml:mrow><mml:msub><mml:mrow><mml:mi>E</mml:mi></mml:mrow><mml:mrow><mml:mi>H</mml:mi></mml:mrow></mml:msub></mml:mrow></mml:mfrac><mml:mo>,</mml:mo></mml:mrow></mml:math><label>(2)</label></disp-formula>where <inline-formula><mml:math display="inline"><mml:mo>ℏ</mml:mo><mml:mi>q</mml:mi></mml:math></inline-formula> is the magnitude of the momentum transfer, <inline-formula><mml:math display="inline"><mml:mi>E</mml:mi></mml:math></inline-formula> is the energy deposition, and <inline-formula><mml:math display="inline"><mml:mi>K</mml:mi></mml:math></inline-formula> is the atomic excitation factor, defined as <xref ref-type="bibr" rid="c26">[26]</xref> <disp-formula id="d3"><mml:math display="block"><mml:mrow><mml:msub><mml:mrow><mml:mi>K</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:mo>≡</mml:mo><mml:msub><mml:mrow><mml:mi>E</mml:mi></mml:mrow><mml:mrow><mml:mi>H</mml:mi></mml:mrow></mml:msub><mml:munder><mml:mrow><mml:mo>∑</mml:mo></mml:mrow><mml:mrow><mml:mi>m</mml:mi></mml:mrow></mml:munder><mml:munder><mml:mrow><mml:mo>∑</mml:mo></mml:mrow><mml:mrow><mml:mi>f</mml:mi></mml:mrow></mml:munder><mml:msup><mml:mrow><mml:mo stretchy="false">|</mml:mo><mml:mrow><mml:mo stretchy="false">⟨</mml:mo><mml:mi>f</mml:mi><mml:mo stretchy="false">|</mml:mo></mml:mrow><mml:msup><mml:mrow><mml:mi>e</mml:mi></mml:mrow><mml:mrow><mml:mi>i</mml:mi><mml:mi mathvariant="bold-italic">q</mml:mi><mml:mo>·</mml:mo><mml:mi mathvariant="bold-italic">r</mml:mi></mml:mrow></mml:msup><mml:mrow><mml:mo stretchy="false">|</mml:mo><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi><mml:mi>m</mml:mi></mml:mrow><mml:mo stretchy="false">⟩</mml:mo></mml:mrow><mml:mo stretchy="false">|</mml:mo></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:msub><mml:mrow><mml:mi>ϱ</mml:mi></mml:mrow><mml:mrow><mml:mi>f</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>E</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mo>.</mml:mo></mml:mrow></mml:math><label>(3)</label></disp-formula>Here, <inline-formula><mml:math display="inline"><mml:msub><mml:mi>ϱ</mml:mi><mml:mi>f</mml:mi></mml:msub></mml:math></inline-formula> is the density of final states, <inline-formula><mml:math display="inline"><mml:mi>m</mml:mi><mml:mo>=</mml:mo><mml:msub><mml:mi>j</mml:mi><mml:mi>z</mml:mi></mml:msub></mml:math></inline-formula>, and the total cross section is to be summed over all electrons <inline-formula><mml:math display="inline"><mml:mrow><mml:mi mathvariant="normal">d</mml:mi><mml:mi>σ</mml:mi><mml:mo>=</mml:mo><mml:mo>∑</mml:mo><mml:mi mathvariant="normal">d</mml:mi><mml:msub><mml:mrow><mml:mi>σ</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub></mml:mrow></mml:math></inline-formula>. The factor of the Hartree energy unit (<inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>E</mml:mi></mml:mrow><mml:mrow><mml:mi>H</mml:mi></mml:mrow></mml:msub><mml:mo>≡</mml:mo><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow></mml:msub><mml:msup><mml:mrow><mml:mi>c</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:msup><mml:mrow><mml:mi>α</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:mo>≃</mml:mo><mml:mn>27.2</mml:mn><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:mi>eV</mml:mi></mml:mrow></mml:math></inline-formula>) is included in Eqs. <xref ref-type="disp-formula" rid="d2">(2)</xref> and <xref ref-type="disp-formula" rid="d3">(3)</xref> in order to make the <inline-formula><mml:math display="inline"><mml:mi>K</mml:mi></mml:math></inline-formula> factor dimensionless (<inline-formula><mml:math display="inline"><mml:mi>q</mml:mi></mml:math></inline-formula> and <inline-formula><mml:math display="inline"><mml:mi>μ</mml:mi></mml:math></inline-formula> have dimensions of inverse length). Since we are considering ionization processes, the final state is a continuum electron with energy <inline-formula><mml:math display="inline"><mml:mrow><mml:mi>ϵ</mml:mi><mml:mo>=</mml:mo><mml:mi>E</mml:mi><mml:mo>-</mml:mo><mml:msub><mml:mrow><mml:mi>I</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub></mml:mrow></mml:math></inline-formula> (<inline-formula><mml:math display="inline"><mml:msub><mml:mi>I</mml:mi><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub></mml:math></inline-formula> is the ionization energy). Formulas for calculating the atomic excitation factor <xref ref-type="disp-formula" rid="d3">(3)</xref> are given in Appendix.</p><p>Equation <xref ref-type="disp-formula" rid="d2">(2)</xref> is to be integrated over all possible values for the momentum transfer. From the conservation of momentum, the allowed values fall in the range between <disp-formula id="d4"><mml:math display="block"><mml:mrow><mml:mo>ℏ</mml:mo><mml:msub><mml:mrow><mml:mi>q</mml:mi></mml:mrow><mml:mrow><mml:mo>±</mml:mo></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:mi>v</mml:mi><mml:mo>±</mml:mo><mml:msqrt><mml:mrow><mml:msubsup><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msubsup><mml:msup><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:mo>-</mml:mo><mml:mn>2</mml:mn><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:mi>E</mml:mi></mml:mrow></mml:msqrt><mml:mo>,</mml:mo></mml:mrow></mml:math><label>(4)</label></disp-formula>where both the DM particle and ejected electron are assumed to be nonrelativistic. For GeV scale WIMPs leaving keV scale energy depositions, the typical momentum transfer is <inline-formula><mml:math display="inline"><mml:mrow><mml:mi>q</mml:mi><mml:mo>∼</mml:mo><mml:msqrt><mml:mrow><mml:mn>2</mml:mn><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:mi>E</mml:mi></mml:mrow></mml:msqrt><mml:mo>∼</mml:mo><mml:mi>MeV</mml:mi></mml:mrow></mml:math></inline-formula>, which is very large on atomic scales <xref ref-type="bibr" rid="c17">[17]</xref>.</p><p>The resulting differential event rate (per unit mass of target material) is proportional to the cross section <xref ref-type="disp-formula" rid="d2">(2)</xref> averaged over incident DM velocities, <disp-formula id="d5"><mml:math display="block"><mml:mrow><mml:mi>d</mml:mi><mml:mi>R</mml:mi><mml:mo>=</mml:mo><mml:mfrac><mml:mrow><mml:msub><mml:mrow><mml:mi>n</mml:mi></mml:mrow><mml:mrow><mml:mi>T</mml:mi></mml:mrow></mml:msub><mml:msub><mml:mrow><mml:mi>ρ</mml:mi></mml:mrow><mml:mrow><mml:mi>DM</mml:mi></mml:mrow></mml:msub></mml:mrow><mml:mrow><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:msup><mml:mrow><mml:mi>c</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup></mml:mrow></mml:mfrac><mml:mfrac><mml:mrow><mml:mi mathvariant="normal">d</mml:mi><mml:mo stretchy="false">⟨</mml:mo><mml:mrow><mml:msub><mml:mrow><mml:mi>σ</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:msub><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub></mml:mrow><mml:mo stretchy="false">⟩</mml:mo></mml:mrow><mml:mrow><mml:mi mathvariant="normal">d</mml:mi><mml:mi>E</mml:mi></mml:mrow></mml:mfrac><mml:mi mathvariant="normal">d</mml:mi><mml:mi>E</mml:mi><mml:mo>,</mml:mo></mml:mrow></mml:math><label>(5)</label></disp-formula>where <inline-formula><mml:math display="inline"><mml:msub><mml:mi>n</mml:mi><mml:mi>T</mml:mi></mml:msub></mml:math></inline-formula> is the number density of target atoms (per unit mass) and <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>ρ</mml:mi></mml:mrow><mml:mrow><mml:mi>DM</mml:mi></mml:mrow></mml:msub><mml:mo>∼</mml:mo><mml:mn>0.3</mml:mn><mml:mi>–</mml:mi><mml:mn>0.4</mml:mn><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:mrow><mml:mi>GeV</mml:mi><mml:mtext> </mml:mtext></mml:mrow><mml:msup><mml:mrow><mml:mi>cm</mml:mi></mml:mrow><mml:mrow><mml:mo>-</mml:mo><mml:mn>3</mml:mn></mml:mrow></mml:msup></mml:mrow></mml:math></inline-formula> is the local DM energy density <xref ref-type="bibr" rid="c44">[44]</xref>. We follow Ref. <xref ref-type="bibr" rid="c45">[45]</xref> and parametrize the velocity-averaged cross section as <disp-formula id="d6"><mml:math display="block"><mml:mrow><mml:mfrac><mml:mrow><mml:mo stretchy="false">⟨</mml:mo><mml:mrow><mml:mi mathvariant="normal">d</mml:mi><mml:mi>σ</mml:mi><mml:mi>v</mml:mi></mml:mrow><mml:mo stretchy="false">⟩</mml:mo></mml:mrow><mml:mrow><mml:mi mathvariant="normal">d</mml:mi><mml:mi>E</mml:mi></mml:mrow></mml:mfrac><mml:mo>=</mml:mo><mml:mfrac><mml:mrow><mml:msub><mml:mrow><mml:mover accent="true"><mml:mrow><mml:mi>σ</mml:mi></mml:mrow><mml:mrow><mml:mo stretchy="false">¯</mml:mo></mml:mrow></mml:mover></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow></mml:msub></mml:mrow><mml:mrow><mml:mn>2</mml:mn><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow></mml:msub><mml:mi>c</mml:mi></mml:mrow></mml:mfrac><mml:mo>∫</mml:mo><mml:mi mathvariant="normal">d</mml:mi><mml:mi>v</mml:mi><mml:mfrac><mml:mrow><mml:mi>f</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mi>v</mml:mi><mml:mo stretchy="false">)</mml:mo></mml:mrow><mml:mrow><mml:mi>v</mml:mi><mml:mo stretchy="false">/</mml:mo><mml:mi>c</mml:mi></mml:mrow></mml:mfrac><mml:msubsup><mml:mrow><mml:mo>∫</mml:mo></mml:mrow><mml:mrow><mml:msub><mml:mrow><mml:mi>q</mml:mi></mml:mrow><mml:mrow><mml:mo>-</mml:mo></mml:mrow></mml:msub></mml:mrow><mml:mrow><mml:msub><mml:mrow><mml:mi>q</mml:mi></mml:mrow><mml:mrow><mml:mo>+</mml:mo></mml:mrow></mml:msub></mml:mrow></mml:msubsup><mml:msubsup><mml:mrow><mml:mi>a</mml:mi></mml:mrow><mml:mrow><mml:mn>0</mml:mn></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msubsup><mml:mi>q</mml:mi><mml:mi mathvariant="normal">d</mml:mi><mml:mi>q</mml:mi><mml:mo stretchy="false">|</mml:mo><mml:msubsup><mml:mrow><mml:mi>F</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow><mml:mrow><mml:mi>μ</mml:mi></mml:mrow></mml:msubsup><mml:mo stretchy="false">(</mml:mo><mml:mi>q</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:msup><mml:mrow><mml:mo stretchy="false">|</mml:mo></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:mrow><mml:mi>K</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mi>E</mml:mi><mml:mo>,</mml:mo><mml:mi>q</mml:mi><mml:mo stretchy="false">)</mml:mo></mml:mrow><mml:mo>,</mml:mo></mml:mrow></mml:math><label>(6)</label></disp-formula>where <inline-formula><mml:math display="inline"><mml:msub><mml:mover accent="true"><mml:mi>σ</mml:mi><mml:mo stretchy="false">¯</mml:mo></mml:mover><mml:mi>e</mml:mi></mml:msub></mml:math></inline-formula> is the free electron cross section at fixed momentum transfer of <inline-formula><mml:math display="inline"><mml:mrow><mml:mi>q</mml:mi><mml:mo>=</mml:mo><mml:msubsup><mml:mrow><mml:mi>a</mml:mi></mml:mrow><mml:mrow><mml:mn>0</mml:mn></mml:mrow><mml:mrow><mml:mo>-</mml:mo><mml:mn>1</mml:mn></mml:mrow></mml:msubsup><mml:mo>,</mml:mo><mml:msub><mml:mrow><mml:mi>a</mml:mi></mml:mrow><mml:mrow><mml:mn>0</mml:mn></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:mo>ℏ</mml:mo><mml:mo stretchy="false">/</mml:mo><mml:mo stretchy="false">(</mml:mo><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow></mml:msub><mml:mi>c</mml:mi><mml:mi>α</mml:mi><mml:mo stretchy="false">)</mml:mo></mml:mrow></mml:math></inline-formula> is the Bohr radius, <inline-formula><mml:math display="inline"><mml:mi>α</mml:mi><mml:mo>≈</mml:mo><mml:mn>1</mml:mn><mml:mo stretchy="false">/</mml:mo><mml:mn>137</mml:mn></mml:math></inline-formula> is the fine-structure constant, and <inline-formula><mml:math display="inline"><mml:mi>f</mml:mi></mml:math></inline-formula> is the DM speed distribution [in the laboratory frame, normalized to <inline-formula><mml:math display="inline"><mml:mo>∫</mml:mo><mml:mi>f</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mi>v</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mi mathvariant="normal">d</mml:mi><mml:mi>v</mml:mi><mml:mo>=</mml:mo><mml:mn>1</mml:mn></mml:math></inline-formula>]. In the case of a vector or scalar mediated interaction such as <xref ref-type="disp-formula" rid="d1">(1)</xref>, these are expressed as <disp-formula id="d7"><mml:math display="block"><mml:mrow><mml:msub><mml:mrow><mml:mover accent="true"><mml:mrow><mml:mi>σ</mml:mi></mml:mrow><mml:mrow><mml:mo stretchy="false">¯</mml:mo></mml:mrow></mml:mover></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:msubsup><mml:mrow><mml:mi>a</mml:mi></mml:mrow><mml:mrow><mml:mn>0</mml:mn></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msubsup><mml:mfrac><mml:mrow><mml:mn>16</mml:mn><mml:mi>π</mml:mi><mml:msup><mml:mrow><mml:mi>α</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:msubsup><mml:mrow><mml:mi>α</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msubsup></mml:mrow><mml:mrow><mml:mo stretchy="false">(</mml:mo><mml:mo stretchy="false">(</mml:mo><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>v</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">/</mml:mo><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow></mml:msub><mml:msup><mml:mrow><mml:mo stretchy="false">)</mml:mo></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:mo>+</mml:mo><mml:msup><mml:mrow><mml:mi>α</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:msup><mml:mrow><mml:mo stretchy="false">)</mml:mo></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup></mml:mrow></mml:mfrac></mml:mrow></mml:math><label>(7)</label></disp-formula><disp-formula id="d8"><mml:math display="block"><mml:mrow><mml:msub><mml:mrow><mml:mi>F</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>q</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mo>=</mml:mo><mml:mfrac><mml:mrow><mml:mo stretchy="false">(</mml:mo><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>v</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">/</mml:mo><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>c</mml:mi></mml:mrow></mml:msub><mml:msup><mml:mrow><mml:mo stretchy="false">)</mml:mo></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:mo>+</mml:mo><mml:msup><mml:mrow><mml:mi>α</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup></mml:mrow><mml:mrow><mml:mo stretchy="false">(</mml:mo><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>v</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">/</mml:mo><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>c</mml:mi></mml:mrow></mml:msub><mml:msup><mml:mrow><mml:mo stretchy="false">)</mml:mo></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:mo>+</mml:mo><mml:mo stretchy="false">(</mml:mo><mml:mi>α</mml:mi><mml:msub><mml:mrow><mml:mi>a</mml:mi></mml:mrow><mml:mrow><mml:mn>0</mml:mn></mml:mrow></mml:msub><mml:mi>q</mml:mi><mml:msup><mml:mrow><mml:mo stretchy="false">)</mml:mo></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup></mml:mrow></mml:mfrac><mml:mo>.</mml:mo></mml:mrow></mml:math><label>(8)</label></disp-formula>We have assumed here that <inline-formula><mml:math display="inline"><mml:msub><mml:mi>m</mml:mi><mml:mi>χ</mml:mi></mml:msub><mml:mo>≫</mml:mo><mml:msub><mml:mi>m</mml:mi><mml:mi>e</mml:mi></mml:msub></mml:math></inline-formula>, which is valid for the considered mass ranges. In the limit of a heavy mediator (contactlike interaction), the DM form factor reduces simply to <inline-formula><mml:math display="inline"><mml:msub><mml:mi>F</mml:mi><mml:mi>χ</mml:mi></mml:msub><mml:mo>=</mml:mo><mml:mn>1</mml:mn></mml:math></inline-formula>, while for an ultralight mediator (Coulomb-like interaction), it reduces to <inline-formula><mml:math display="inline"><mml:msub><mml:mi>F</mml:mi><mml:mi>χ</mml:mi></mml:msub><mml:mo>=</mml:mo><mml:mo stretchy="false">(</mml:mo><mml:msub><mml:mi>a</mml:mi><mml:mn>0</mml:mn></mml:msub><mml:mi>q</mml:mi><mml:msup><mml:mo stretchy="false">)</mml:mo><mml:mrow><mml:mo>-</mml:mo><mml:mn>2</mml:mn></mml:mrow></mml:msup></mml:math></inline-formula>. This is a convenient way to parametrize the calculations and allows for easy model-independent comparison between different results.</p><p>There is no contribution to the event rate stemming from DM velocities below <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>min</mml:mi></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:msqrt><mml:mrow><mml:mn>2</mml:mn><mml:mi>E</mml:mi><mml:mo stretchy="false">/</mml:mo><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub></mml:mrow></mml:msqrt></mml:mrow></mml:math></inline-formula>, the minimum required to deposit energy <inline-formula><mml:math display="inline"><mml:mi>E</mml:mi></mml:math></inline-formula>. If the majority of the target momentum-space wave function density lies inside the <inline-formula><mml:math display="inline"><mml:mo stretchy="false">(</mml:mo><mml:msub><mml:mi>q</mml:mi><mml:mo>-</mml:mo></mml:msub><mml:mo>,</mml:mo><mml:msub><mml:mi>q</mml:mi><mml:mo>+</mml:mo></mml:msub><mml:mo stretchy="false">)</mml:mo></mml:math></inline-formula> region, then the integration over <inline-formula><mml:math display="inline"><mml:mi>q</mml:mi></mml:math></inline-formula> in Eq. <xref ref-type="disp-formula" rid="d2">(2)</xref> is essentially independent of the integration limits, so one may write <disp-formula id="und1"><mml:math display="block"><mml:mrow><mml:mrow><mml:mo stretchy="false">⟨</mml:mo><mml:mrow><mml:mi mathvariant="normal">d</mml:mi><mml:mi>σ</mml:mi><mml:mi>v</mml:mi></mml:mrow><mml:mo stretchy="false">⟩</mml:mo></mml:mrow><mml:mo>∝</mml:mo><mml:mi>η</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:msub><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>min</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">)</mml:mo><mml:mo>∫</mml:mo><mml:mi>q</mml:mi><mml:mi mathvariant="normal">d</mml:mi><mml:mi>q</mml:mi><mml:mo stretchy="false">|</mml:mo><mml:msub><mml:mrow><mml:mi>F</mml:mi></mml:mrow><mml:mrow><mml:mi>DM</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>q</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:msup><mml:mrow><mml:mo stretchy="false">|</mml:mo></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:mi>K</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mi>E</mml:mi><mml:mo>,</mml:mo><mml:mi>q</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mi mathvariant="normal">d</mml:mi><mml:mi>E</mml:mi><mml:mo>,</mml:mo></mml:mrow></mml:math></disp-formula>where <inline-formula><mml:math display="inline"><mml:mi>η</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:msub><mml:mi>v</mml:mi><mml:mi>min</mml:mi></mml:msub><mml:mo stretchy="false">)</mml:mo></mml:math></inline-formula> is the mean inverse speed of DM particles fast enough to cause the ionization (<inline-formula><mml:math display="inline"><mml:mi>v</mml:mi><mml:mo>&gt;</mml:mo><mml:msub><mml:mi>v</mml:mi><mml:mi>min</mml:mi></mml:msub></mml:math></inline-formula>) for the given velocity distribution. This is a common way to calculate DM direct detection event rates, particularly for nuclear recoils; however, we note that in the case of electron scattering it is not valid. The cross section depends strongly on <inline-formula><mml:math display="inline"><mml:msub><mml:mi>q</mml:mi><mml:mo>-</mml:mo></mml:msub></mml:math></inline-formula> and hence the DM velocity, since, in many cases, the bulk of the electron momentum-space wave function lies below the allowed region for momentum transfer. This means that a careful treatment of the DM speed distribution, including uncertainties, is required for the analysis (see also Ref. <xref ref-type="bibr" rid="c46">[46]</xref>).</p></sec><sec id="s2b"><label>B.</label><title>Calculation of the atomic ionization factor</title><p>In Fig. <xref ref-type="fig" rid="f1">1</xref>, we show a comparison of the atomic ionization factor as calculated using a number of different approximations, as a function of the momentum transfer <inline-formula><mml:math display="inline"><mml:mi>q</mml:mi></mml:math></inline-formula> (for fixed <inline-formula><mml:math display="inline"><mml:mi>E</mml:mi></mml:math></inline-formula>). For the values relevant to this work, around <inline-formula><mml:math display="inline"><mml:mrow><mml:mi>q</mml:mi><mml:mo>∼</mml:mo><mml:mn>1</mml:mn><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:mi>MeV</mml:mi></mml:mrow></mml:math></inline-formula>, there are almost 4 orders of magnitude difference between the various approximations. Also note that the relativistic effects are very important for large <inline-formula><mml:math display="inline"><mml:mi>q</mml:mi></mml:math></inline-formula>, and the corrections continue grow with increasing <inline-formula><mml:math display="inline"><mml:mi>q</mml:mi></mml:math></inline-formula> <xref ref-type="bibr" rid="c26">[26]</xref>.</p><fig id="f1"><object-id>1</object-id><object-id pub-id-type="doi">10.1103/PhysRevD.100.063017.f1</object-id><label>FIG. 1.</label><caption><p>Atomic factor <inline-formula><mml:math display="inline"><mml:mi>K</mml:mi></mml:math></inline-formula> <xref ref-type="disp-formula" rid="d3">(3)</xref> for the <inline-formula><mml:math display="inline"><mml:mn>3</mml:mn><mml:mi>s</mml:mi></mml:math></inline-formula> state of Xe at fixed energy (2 keV), calculated using different approximations. For the <inline-formula><mml:math display="inline"><mml:mn>3</mml:mn><mml:mi>s</mml:mi></mml:math></inline-formula> Xe state, we have <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>Z</mml:mi></mml:mrow><mml:mrow><mml:mi>eff</mml:mi></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:mi>n</mml:mi><mml:msqrt><mml:mrow><mml:mn>2</mml:mn><mml:msub><mml:mrow><mml:mi>I</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">/</mml:mo><mml:msub><mml:mrow><mml:mi>E</mml:mi></mml:mrow><mml:mrow><mml:mi>H</mml:mi></mml:mrow></mml:msub></mml:mrow></mml:msqrt><mml:mo>≃</mml:mo><mml:mn>28</mml:mn></mml:mrow></mml:math></inline-formula>.</p></caption><graphic xlink:href="e063017_1.eps"/></fig><p>Since the typical kinetic energy of a <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:mo>∼</mml:mo><mml:mi mathvariant="normal">G</mml:mi><mml:mi mathvariant="normal">e</mml:mi><mml:mi mathvariant="normal">V</mml:mi></mml:mrow></mml:math></inline-formula> mass WIMP is large compared to typical atomic transition energies, the minimum momentum transfer is given by <inline-formula><mml:math display="inline"><mml:mrow><mml:mo>ℏ</mml:mo><mml:msub><mml:mrow><mml:mi>q</mml:mi></mml:mrow><mml:mrow><mml:mi>min</mml:mi></mml:mrow></mml:msub><mml:mo>∼</mml:mo><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:msub><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:mo>∼</mml:mo><mml:mi>E</mml:mi><mml:mo stretchy="false">/</mml:mo><mml:msub><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub></mml:mrow></mml:math></inline-formula> <xref ref-type="disp-formula" rid="d4">(4)</xref>. Therefore, we see that <inline-formula><mml:math display="inline"><mml:mrow><mml:mo>ℏ</mml:mo><mml:msub><mml:mrow><mml:mi>q</mml:mi></mml:mrow><mml:mrow><mml:mi>min</mml:mi></mml:mrow></mml:msub><mml:mo>≳</mml:mo><mml:mspace linebreak="goodbreak"/><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow></mml:msub><mml:msubsup><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msubsup><mml:mo stretchy="false">/</mml:mo><mml:msub><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:msub><mml:mrow><mml:mi>p</mml:mi></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:msub><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">/</mml:mo><mml:msub><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">)</mml:mo><mml:mo>≫</mml:mo><mml:msub><mml:mrow><mml:mi>p</mml:mi></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow></mml:msub></mml:mrow></mml:math></inline-formula>, with <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow></mml:msub><mml:mo>∼</mml:mo><mml:mi>α</mml:mi><mml:mi>c</mml:mi><mml:mo>-</mml:mo><mml:mi>Z</mml:mi><mml:mi>α</mml:mi><mml:mi>c</mml:mi></mml:mrow></mml:math></inline-formula> being the typical velocity of an atomic electron. The consequence is that only the very high-momentum tail of the wave functions (in momentum space) can contribute to such processes. In position space, this part of the wave function comes from distances very close to the nucleus. For a detailed discussion, see Ref. <xref ref-type="bibr" rid="c26">[26]</xref>.</p><p>Therefore, care must be taken to perform the calculations of such processes correctly. For example, it is common to calculate such processes using analytic hydrogenlike wave functions, with an effective nuclear charge, which is chosen to reproduce experimental binding energies: <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>Z</mml:mi></mml:mrow><mml:mrow><mml:mi>eff</mml:mi></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:mi>n</mml:mi><mml:msqrt><mml:mrow><mml:mn>2</mml:mn><mml:msub><mml:mrow><mml:mi>I</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">/</mml:mo><mml:msub><mml:mrow><mml:mi>E</mml:mi></mml:mrow><mml:mrow><mml:mi>H</mml:mi></mml:mrow></mml:msub></mml:mrow></mml:msqrt></mml:mrow></mml:math></inline-formula>. While such functions give a reasonable approximation for low <inline-formula><mml:math display="inline"><mml:mi>q</mml:mi></mml:math></inline-formula>, for the large <inline-formula><mml:math display="inline"><mml:mi>q</mml:mi></mml:math></inline-formula> values important for this work, they drastically underestimate the cross section. This is because such functions have incorrect scaling at distances close to the nucleus, which is the only part of the electron wave function that can contribute enough momentum transfer.</p><p>Another common approach is to approximate the outgoing ionization electron wave function as a plane-wave state. Such functions also have the incorrect scaling at small distances and underestimate the cross section by orders of magnitude for large <inline-formula><mml:math display="inline"><mml:mi>q</mml:mi></mml:math></inline-formula>. (This is mostly due to the missing Sommerfeld enhancement as discussed in Ref. <xref ref-type="bibr" rid="c47">[47]</xref>.) More details regarding this point are given in Appendix.</p><p>Therefore, to perform accurate calculations, one must employ a technique known to accurately reproduce the electron orbitals, namely, the relativistic Hartree-Fock method, including finite-nuclear size, and using continuum energy eigenstates as the outgoing electron orbitals. Detailed calculations and discussion were presented in Ref. <xref ref-type="bibr" rid="c17">[17]</xref>. Formulas are given in Appendix.</p><p>Given the extreme dependence on the atomic physics seen in Fig. <xref ref-type="fig" rid="f1">1</xref>, it is important to estimate the uncertainty in the calculations. To gauge this, we also calculate the cross section using other (simpler) methods. Namely, we exclude the effect of the exchange potential from the Hartree-Fock method and also solve the Dirac equations using only a local parametric potential (chosen to reproduce the ionization energies) instead of the Hartree-Fock equations. The effect this has on the calculations is very small, with the main difference coming from small changes in the calculated values for the ionization energies. This is as expected, since the cross section is due mainly to the value of the wave functions on small distances, close to the nucleus, where many-body electron effects are less important (but the correct scaling is crucial). All of these methods (unlike the effective <inline-formula><mml:math display="inline"><mml:mi>Z</mml:mi></mml:math></inline-formula> method, or plane-wave assumption) give the correct small-<inline-formula><mml:math display="inline"><mml:mrow><mml:mi>r</mml:mi></mml:mrow></mml:math></inline-formula> scaling of the bound and continuum electron orbitals.</p><p>The finite-nuclear size correction is important for large values of <inline-formula><mml:math display="inline"><mml:mi>q</mml:mi></mml:math></inline-formula> but is small compared to the relativistic corrections and ultimately is not a leading source of error. In any case, we include this in an <italic>ab initio</italic> manner, by directly solving the electron Dirac equation in the field created by the nuclear charge density, which we take to be given by a Fermi distribution, <inline-formula><mml:math display="inline"><mml:mrow><mml:mi>ρ</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mi>r</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mo>=</mml:mo><mml:mspace linebreak="goodbreak"/><mml:msub><mml:mrow><mml:mi>ρ</mml:mi></mml:mrow><mml:mrow><mml:mn>0</mml:mn></mml:mrow></mml:msub><mml:mo stretchy="false">[</mml:mo><mml:mn>1</mml:mn><mml:mo>+</mml:mo><mml:mi>exp</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mi>r</mml:mi><mml:mo>-</mml:mo><mml:mi>c</mml:mi><mml:mo stretchy="false">/</mml:mo><mml:mi>a</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:msup><mml:mrow><mml:mo stretchy="false">]</mml:mo></mml:mrow><mml:mrow><mml:mo>-</mml:mo><mml:mn>1</mml:mn></mml:mrow></mml:msup></mml:mrow></mml:math></inline-formula>. Here, <inline-formula><mml:math display="inline"><mml:mrow><mml:mi>t</mml:mi><mml:mo>≡</mml:mo><mml:mn>4</mml:mn><mml:mi>a</mml:mi><mml:mi>ln</mml:mi><mml:mn>3</mml:mn><mml:mo>≃</mml:mo><mml:mn>2.3</mml:mn><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:mi>fm</mml:mi></mml:mrow></mml:math></inline-formula> and <inline-formula><mml:math display="inline"><mml:mrow><mml:mi>c</mml:mi><mml:mo>≃</mml:mo><mml:mn>1.1</mml:mn><mml:msup><mml:mrow><mml:mi>A</mml:mi></mml:mrow><mml:mrow><mml:mn>1</mml:mn><mml:mo stretchy="false">/</mml:mo><mml:mn>3</mml:mn></mml:mrow></mml:msup><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:mi>fm</mml:mi></mml:mrow></mml:math></inline-formula> are the nuclear skin-thickness and half-density radius, respectively, e.g., Ref. <xref ref-type="bibr" rid="c48">[48]</xref>, and <inline-formula><mml:math display="inline"><mml:msub><mml:mi>ρ</mml:mi><mml:mn>0</mml:mn></mml:msub></mml:math></inline-formula> is the normalization factor. We note that the uncertainties stemming from the atomic physics errors are small compared to those coming from the assumed dark matter velocity distribution and detector performance, as discussed in the following sections.</p><p>Plots of the velocity averaged differential cross sections for several WIMP masses and mediator types are presented in Fig. <xref ref-type="fig" rid="f2">2</xref>. We find very good agreement with similar recent calculations for Xe atoms in Ref. <xref ref-type="bibr" rid="c49">[49]</xref>. We present these plots for the xenon atom, since it is the most common target material. For DAMA/LIBRA experiment, the cross section is dominated by scattering off iodine (<inline-formula><mml:math display="inline"><mml:mi>Z</mml:mi><mml:mo>=</mml:mo><mml:mn>53</mml:mn></mml:math></inline-formula>), which has an electron structure very similar to that of xenon (<inline-formula><mml:math display="inline"><mml:mi>Z</mml:mi><mml:mo>=</mml:mo><mml:mn>54</mml:mn></mml:math></inline-formula>).</p><fig id="f2"><object-id>2</object-id><object-id pub-id-type="doi">10.1103/PhysRevD.100.063017.f2</object-id><label>FIG. 2.</label><caption><p>Velocity-averaged differential cross section for a single Xe atom, with <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mover accent="true"><mml:mrow><mml:mi>σ</mml:mi></mml:mrow><mml:mrow><mml:mo stretchy="false">¯</mml:mo></mml:mrow></mml:mover></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:msup><mml:mrow><mml:mn>10</mml:mn></mml:mrow><mml:mrow><mml:mo>-</mml:mo><mml:mn>37</mml:mn></mml:mrow></mml:msup><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:msup><mml:mrow><mml:mi>cm</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup></mml:mrow></mml:math></inline-formula>. The left panel is for a contact (heavy mediator) interaction, and the right is for a long-range (Coulomb-like) interaction. The kinks in the plots are due to the opening up of deeper electron shells. There is no signal above <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>E</mml:mi></mml:mrow><mml:mrow><mml:mi>max</mml:mi></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:msubsup><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>max</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msubsup><mml:mo stretchy="false">/</mml:mo><mml:mn>2</mml:mn></mml:mrow></mml:math></inline-formula>, where <inline-formula><mml:math display="inline"><mml:msub><mml:mi>v</mml:mi><mml:mi>max</mml:mi></mml:msub></mml:math></inline-formula> is the maximum DM velocity.</p></caption><graphic xlink:href="e063017_2.eps"/></fig></sec><sec id="s2c"><label>C.</label><title>Annual modulation</title><p>We assume the DM velocity distribution is described by the standard halo model, with a cutoff (in the galactic rest frame) of <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>esc</mml:mi></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:mn>550</mml:mn><mml:mo stretchy="false">(</mml:mo><mml:mn>55</mml:mn><mml:mo stretchy="false">)</mml:mo><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:mi>km</mml:mi><mml:mo>/</mml:mo><mml:mi mathvariant="normal">s</mml:mi></mml:mrow></mml:math></inline-formula>, and a circular velocity of <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mn>0</mml:mn></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:mn>220</mml:mn><mml:mo stretchy="false">(</mml:mo><mml:mn>20</mml:mn><mml:mo stretchy="false">)</mml:mo><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:mi>km</mml:mi><mml:mo>/</mml:mo><mml:mi mathvariant="normal">s</mml:mi></mml:mrow></mml:math></inline-formula>; see, e.g., Ref. <xref ref-type="bibr" rid="c6 c50">[6,50]</xref>. The numbers in the parentheses above represent estimates for the uncertainties in the values. This is important, due to the strong velocity dependence of the cross section (see also, e.g., Ref. <xref ref-type="bibr" rid="c46">[46]</xref>). We use these uncertainties to estimate the resulting uncertainty in the calculated event rates.</p><p>For the calculations, the velocity distribution is boosted into the Earth frame, which has a speed of <disp-formula id="d9"><mml:math display="block"><mml:mrow><mml:msub><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>E</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>t</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mo>≈</mml:mo><mml:msub><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>L</mml:mi></mml:mrow></mml:msub><mml:mo>+</mml:mo><mml:msub><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>orb</mml:mi></mml:mrow></mml:msub><mml:mi>cos</mml:mi><mml:mi>β</mml:mi><mml:mi>cos</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mrow><mml:mn>2</mml:mn><mml:mi>π</mml:mi></mml:mrow><mml:mo>·</mml:mo><mml:msup><mml:mrow><mml:mi>yr</mml:mi></mml:mrow><mml:mrow><mml:mo>-</mml:mo><mml:mn>1</mml:mn></mml:mrow></mml:msup><mml:mi>t</mml:mi><mml:mo>+</mml:mo><mml:mi>ϕ</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mo>.</mml:mo></mml:mrow></mml:math><label>(9)</label></disp-formula>Here, <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>L</mml:mi></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:msub><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mn>0</mml:mn></mml:mrow></mml:msub><mml:mo>+</mml:mo><mml:mn>13</mml:mn><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:mrow><mml:mi>km</mml:mi><mml:mo>/</mml:mo><mml:mi mathvariant="normal">s</mml:mi></mml:mrow></mml:mrow></mml:math></inline-formula> is the average local rest frame velocity, accounting for the peculiar motion of the Sun, <inline-formula><mml:math display="inline"><mml:msub><mml:mi>v</mml:mi><mml:mrow><mml:mi>orb</mml:mi></mml:mrow></mml:msub></mml:math></inline-formula> is the Earth’s orbital velocity, and <inline-formula><mml:math display="inline"><mml:mi>cos</mml:mi><mml:mi>β</mml:mi><mml:mo>≈</mml:mo><mml:mn>0.49</mml:mn></mml:math></inline-formula> accounts for the inclination of Earth’s orbit to the Galactic plane. The <inline-formula><mml:math display="inline"><mml:mi>cos</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mi>ω</mml:mi><mml:mi>t</mml:mi><mml:mo stretchy="false">)</mml:mo></mml:math></inline-formula> term accounts of the annual change in the local frame velocity due to the orbital motion around the Sun, with phase <inline-formula><mml:math display="inline"><mml:mi>ϕ</mml:mi></mml:math></inline-formula> chosen such that <inline-formula><mml:math display="inline"><mml:msub><mml:mi>v</mml:mi><mml:mi>E</mml:mi></mml:msub></mml:math></inline-formula> is maximum on June 2, when the Earth and Sun velocities add maximally in the Galactic halo frame.</p><p>Due to the strong velocity dependence of the cross section, the resulting event rates are not perfectly sinusoidal, particularly at higher energies and lower WIMP masses <xref ref-type="bibr" rid="c17">[17]</xref>. However, the general sinusoidal feature remains a reasonable approximation. We define the modulation amplitude as <inline-formula><mml:math display="inline"><mml:mrow><mml:mo stretchy="false">(</mml:mo><mml:msub><mml:mrow><mml:mi>R</mml:mi></mml:mrow><mml:mrow><mml:mi>max</mml:mi></mml:mrow></mml:msub><mml:mo>-</mml:mo><mml:msub><mml:mrow><mml:mi>R</mml:mi></mml:mrow><mml:mrow><mml:mi>min</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">)</mml:mo><mml:mo stretchy="false">/</mml:mo><mml:mn>2</mml:mn></mml:mrow></mml:math></inline-formula>.</p></sec></sec><sec id="s3"><label>III.</label><title>IMPLICATIONS FROM DAMA/LIBRA-PHASE2</title><p>In order to calculate the number of events detected within a particular energy range, the energy resolution of the detectors must be taken into account. To do this, we follow the procedure from Ref. <xref ref-type="bibr" rid="c14">[14]</xref> and take the detector resolution to be described by a Gaussian with standard deviation <disp-formula id="d10"><mml:math display="block"><mml:mrow><mml:msub><mml:mrow><mml:mi>σ</mml:mi></mml:mrow><mml:mrow><mml:mi>LE</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">/</mml:mo><mml:mi>E</mml:mi><mml:mo>=</mml:mo><mml:msub><mml:mrow><mml:mi>α</mml:mi></mml:mrow><mml:mrow><mml:mi>LE</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">/</mml:mo><mml:msqrt><mml:mrow><mml:mi>E</mml:mi><mml:mo stretchy="false">/</mml:mo><mml:mi>keV</mml:mi></mml:mrow></mml:msqrt><mml:mo>+</mml:mo><mml:msub><mml:mrow><mml:mi>β</mml:mi></mml:mrow><mml:mrow><mml:mi>LE</mml:mi></mml:mrow></mml:msub><mml:mo>,</mml:mo></mml:mrow></mml:math><label>(10)</label></disp-formula>which is measured at low energy to be given by <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>α</mml:mi></mml:mrow><mml:mrow><mml:mi>LE</mml:mi></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:mn>0.45</mml:mn><mml:mo stretchy="false">(</mml:mo><mml:mn>4</mml:mn><mml:mo stretchy="false">)</mml:mo></mml:mrow></mml:math></inline-formula>, and <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>β</mml:mi></mml:mrow><mml:mrow><mml:mi>LE</mml:mi></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:mn>9</mml:mn><mml:mo stretchy="false">(</mml:mo><mml:mn>5</mml:mn><mml:mo stretchy="false">)</mml:mo><mml:mrow><mml:mo>×</mml:mo><mml:msup><mml:mrow><mml:mn>10</mml:mn></mml:mrow><mml:mrow><mml:mo>-</mml:mo><mml:mn>3</mml:mn></mml:mrow></mml:msup></mml:mrow></mml:mrow></mml:math></inline-formula> <xref ref-type="bibr" rid="c51">[51]</xref>. The calculated rate, <inline-formula><mml:math display="inline"><mml:mi>R</mml:mi></mml:math></inline-formula>, is integrated with the Gaussian profile to determine the observable event rate, <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi></mml:math></inline-formula>, <disp-formula id="d11"><mml:math display="block"><mml:mrow><mml:mfrac><mml:mrow><mml:mi mathvariant="normal">d</mml:mi><mml:mi>S</mml:mi></mml:mrow><mml:mrow><mml:mi mathvariant="normal">d</mml:mi><mml:mi>E</mml:mi></mml:mrow></mml:mfrac><mml:mo>=</mml:mo><mml:msubsup><mml:mrow><mml:mo>∫</mml:mo></mml:mrow><mml:mrow><mml:msub><mml:mrow><mml:mi>E</mml:mi></mml:mrow><mml:mrow><mml:mi>HW</mml:mi></mml:mrow></mml:msub></mml:mrow><mml:mrow><mml:mi>∞</mml:mi></mml:mrow></mml:msubsup><mml:msub><mml:mrow><mml:mi>g</mml:mi></mml:mrow><mml:mrow><mml:msub><mml:mrow><mml:mi>σ</mml:mi></mml:mrow><mml:mrow><mml:mi>LE</mml:mi></mml:mrow></mml:msub></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:msup><mml:mrow><mml:mi>E</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:mo>-</mml:mo><mml:mi>E</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mfrac><mml:mrow><mml:mi mathvariant="normal">d</mml:mi><mml:mi>R</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:msup><mml:mrow><mml:mi>E</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:mo stretchy="false">)</mml:mo></mml:mrow><mml:mrow><mml:mi mathvariant="normal">d</mml:mi><mml:msup><mml:mrow><mml:mi>E</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup></mml:mrow></mml:mfrac><mml:mi mathvariant="normal">d</mml:mi><mml:msup><mml:mrow><mml:mi>E</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:mo>,</mml:mo></mml:mrow></mml:math><label>(11)</label></disp-formula>where <inline-formula><mml:math display="inline"><mml:msub><mml:mi>E</mml:mi><mml:mrow><mml:mi>HW</mml:mi></mml:mrow></mml:msub></mml:math></inline-formula> is the hardware threshold, which for DAMA is one photoelectron <xref ref-type="bibr" rid="c51">[51]</xref>. The extracted number of photoelectrons is measured by the DAMA Collaboration to be <inline-formula><mml:math display="inline"><mml:mrow><mml:mn>5.5</mml:mn><mml:mi>–</mml:mi><mml:mn>7.5</mml:mn><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:mi>photoelectrons</mml:mi><mml:mo>/</mml:mo><mml:mi>keV</mml:mi></mml:mrow></mml:math></inline-formula>, depending on the detector <xref ref-type="bibr" rid="c51">[51]</xref>. We take an average value of 6.5, with <inline-formula><mml:math display="inline"><mml:mo>±</mml:mo><mml:mn>1</mml:mn></mml:math></inline-formula> as an error term, so that <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>E</mml:mi></mml:mrow><mml:mrow><mml:mi>HW</mml:mi></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:mn>0.15</mml:mn><mml:mo stretchy="false">(</mml:mo><mml:mn>3</mml:mn><mml:mo stretchy="false">)</mml:mo><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:mi>keV</mml:mi></mml:mrow></mml:math></inline-formula>. We do not take the detector efficiency into account because the DAMA Collaboration presents its results corrected for this <xref ref-type="bibr" rid="c23">[23]</xref>.</p><p>The effect of the finite detector resolution is that it allows events that originally occur at lower energies to be visible in the observed data above the threshold. This is particularly important due to the strong enhancement in the cross section at low energies (see Fig. <xref ref-type="fig" rid="f2">2</xref>).</p><p>Due to the strong atomic number <inline-formula><mml:math display="inline"><mml:mi>Z</mml:mi></mml:math></inline-formula> dependence, the cross section for scattering off sodium electrons is negligible <xref ref-type="bibr" rid="c17">[17]</xref>. So, for the DAMA NaI crystals, it is sufficient to calculate the rate due to scattering of the iodine electrons. We have treated iodine as though it were a free atom, whereas, in fact, it is bound in the NaI solid. Only the outermost <inline-formula><mml:math display="inline"><mml:mn>5</mml:mn><mml:mi>p</mml:mi></mml:math></inline-formula> orbitals are involved in binding. However, even after accounting for the detector resolution, the <inline-formula><mml:math display="inline"><mml:mn>5</mml:mn><mml:mi>p</mml:mi></mml:math></inline-formula> (and <inline-formula><mml:math display="inline"><mml:mn>5</mml:mn><mml:mi>s</mml:mi></mml:math></inline-formula>) orbitals contribute negligibly, with the dominant contribution at approximately 1–2 keV coming from the inner <inline-formula><mml:math display="inline"><mml:mn>3</mml:mn><mml:mi>s</mml:mi></mml:math></inline-formula> shell, which is very well described by atomic wave functions.</p><p>Using this approach, we calculate the expected event rate and annual modulation amplitude for DAMA, as a function of the incident WIMP mass, assuming both an ultralight and superheavy mediator. Due to the very large enhancement in the expected event rate at smaller energies, the calculated modulation amplitude is a poor fit to the observed DAMA spectrum. In Fig. <xref ref-type="fig" rid="f3">3</xref>, we present the calculated spectrum alongside the DAMA/LIBRA-phase2 data <xref ref-type="bibr" rid="c23">[23]</xref>. For the coupling strength (parametrized in terms of <inline-formula><mml:math display="inline"><mml:msub><mml:mover accent="true"><mml:mi>σ</mml:mi><mml:mo stretchy="false">¯</mml:mo></mml:mover><mml:mi>e</mml:mi></mml:msub></mml:math></inline-formula>), we have fitted the expected event rate to the observed DAMA modulation signal only for the lowest 1–2 keV bins. Taking the higher-energy bins into account can only increase the best-fit value for <inline-formula><mml:math display="inline"><mml:msub><mml:mover accent="true"><mml:mi>σ</mml:mi><mml:mo stretchy="false">¯</mml:mo></mml:mover><mml:mi>e</mml:mi></mml:msub></mml:math></inline-formula>, so (as discussed below) this is the most conservative choice.</p><fig id="f3"><object-id>3</object-id><object-id pub-id-type="doi">10.1103/PhysRevD.100.063017.f3</object-id><label>FIG. 3.</label><caption><p>Calculated modulation amplitude for NaI, accounting for the DAMA detector resolution, with <inline-formula><mml:math display="inline"><mml:msub><mml:mover accent="true"><mml:mi>σ</mml:mi><mml:mo stretchy="false">¯</mml:mo></mml:mover><mml:mi>e</mml:mi></mml:msub></mml:math></inline-formula> chosen to reproduce the observed DAMA/LIBRA-phase2 modulation amplitude averaged across the 1–2 keV energy bin. The black points are the combined DAMA/LIBRA data (the points below 2 keV from phase2 alone) <xref ref-type="bibr" rid="c23">[23]</xref>. The shaded blue region shows the uncertainties from the calculations (this work), which are mostly due to uncertainties in the DAMA energy resolution. The plot is drawn assuming <inline-formula><mml:math display="inline"><mml:msub><mml:mi>m</mml:mi><mml:mi>χ</mml:mi></mml:msub><mml:mo>=</mml:mo><mml:mn>1</mml:mn><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:mi>GeV</mml:mi></mml:math></inline-formula> for a contactlike interaction (left) and a long-range interaction (right). Clearly, the fit is poor.</p></caption><graphic xlink:href="e063017_3.eps"/></fig><p>In Fig. <xref ref-type="fig" rid="f4">4</xref>, we plot the best-fit regions for the lowest-energy DAMA/LIBRA-phase2 modulation signal, as a function of possible DM masses <inline-formula><mml:math display="inline"><mml:msub><mml:mi>m</mml:mi><mml:mi>χ</mml:mi></mml:msub></mml:math></inline-formula> and coupling strengths <inline-formula><mml:math display="inline"><mml:msub><mml:mover accent="true"><mml:mi>σ</mml:mi><mml:mo stretchy="false">¯</mml:mo></mml:mover><mml:mi>e</mml:mi></mml:msub></mml:math></inline-formula>. Despite the large enhancement in the expected event rate at the lower energies, and the conservative assumptions made for extracting the best fit, the interpretation of the observed modulation amplitude in terms of electron-interacting dark matter is inconsistent with existing bounds. All regions of parameter space that could possibly explain the observed DAMA signal are excluded by constraints derived in Ref. <xref ref-type="bibr" rid="c35">[35]</xref>, using <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>2</mml:mn></mml:math></inline-formula> “ionization-only” results from the XENON10 <xref ref-type="bibr" rid="c19">[19]</xref> and XENON100 <xref ref-type="bibr" rid="c52">[52]</xref> experiments.</p><fig id="f4"><object-id>4</object-id><object-id pub-id-type="doi">10.1103/PhysRevD.100.063017.f4</object-id><label>FIG. 4.</label><caption><p>The black line shows the calculated value for <inline-formula><mml:math display="inline"><mml:msub><mml:mover accent="true"><mml:mi>σ</mml:mi><mml:mo stretchy="false">¯</mml:mo></mml:mover><mml:mi>e</mml:mi></mml:msub></mml:math></inline-formula> required to reproduce the observed DAMA modulation signal over the 1–2 keV energy bin, as a function of the WIMP mass for the heavy (left) and ultralight (right) mediator cases. The green shaded region shows the 90% C.L. region for the fit, taking into account uncertainties stemming from the detector resolution, standard halo model, and atomic physics errors. The red and blue curves are the 90% C.L. exclusions from Ref. <xref ref-type="bibr" rid="c35">[35]</xref>, derived from the <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>2</mml:mn></mml:math></inline-formula> ionization signals from the XENON10 and XENON100 experiments, respectively. The “DAMA-allowed” regions are excluded for all relevant WIMP masses by these bounds. The fit for DAMA was performed by averaging over just the lowest-energy bins without regard to the shape of the spectrum. Taking the higher-energy bins into account pushes the DAMA region higher, strengthening this conclusion (see Fig. <xref ref-type="fig" rid="f3">3</xref>).</p></caption><graphic xlink:href="e063017_4.eps"/></fig><p>Note the large uncertainties visible in the plots in Figs. <xref ref-type="fig" rid="f3">3</xref> and <xref ref-type="fig" rid="f4">4</xref>. The dominating source of error comes from the uncertainties in the detector response and energy resolution. Sizable errors also arise due to uncertainties in the standard halo model DM velocity distribution. Uncertainties coming from the atomic physics calculations are also included but are negligible. The uncertainties in the detector resolution and DM velocities themselves are not so large (approximately 10%)—but they lead to very large uncertainties (up to an order of magnitude) in the observable event rate. This is due to the very strong enhancement in the event rate at low energies, which makes the observed rate very sensitive to the detector cutoffs and energy resolution. Clearly, taking these uncertainties into account is crucial.</p></sec><sec id="s4"><label>IV.</label><title>PROPSECTS FOR LIQUID XENON DETECTORS</title><p>In this section, we discuss the prospects for the detection of light (GeV scale) WIMPs using xenon dual-phase time projection chambers. (We base our discussion here on XENON Collaboration detectors; see e.g., Ref. <xref ref-type="bibr" rid="c53">[53]</xref>. Similar principals apply for other experiments.) When a scattering event occurs in the liquid xenon bulk of such a detector, a prompt <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>1</mml:mn></mml:math></inline-formula> scintillation signal is induced, which is proportional to the total energy deposited in the detector. Then, any ionized electrons are drifted upward through the liquid/gas boundary (via an applied electric field), where a secondary scintillation signal (<inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>2</mml:mn></mml:math></inline-formula>) that is proportional to the number of ionized electrons may be observed. Combining the <inline-formula><mml:math display="inline"><mml:mrow><mml:mrow><mml:mi>x</mml:mi></mml:mrow><mml:mo>,</mml:mo><mml:mrow><mml:mi>y</mml:mi></mml:mrow></mml:mrow></mml:math></inline-formula> spatial resolution of the top and bottom photodetectors with the <inline-formula><mml:math display="inline"><mml:mi>z</mml:mi></mml:math></inline-formula>-resolution from the time between the <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>1</mml:mn></mml:math></inline-formula> and <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>2</mml:mn></mml:math></inline-formula> signals allows three-dimensional reconstruction of the event geometry. This allows for the “fiducialization” of the target material, where only scattering events occurring within the inner volume of the detector are included in the analysis. This is an important stage of background rejection, since charged particles are much more likely to scatter quickly, i.e., at the outer regions of the xenon chamber, whereas feebly interacting particles such as WIMPs are equally likely to scatter anywhere within the detector volume. Further, the ratio between the relative strengths of the <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>1</mml:mn></mml:math></inline-formula> and <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>2</mml:mn></mml:math></inline-formula> signals may be used to distinguish between nuclear and electronic scattering events. The combination of both the <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>1</mml:mn></mml:math></inline-formula> and <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>2</mml:mn></mml:math></inline-formula> signals is thus key to understanding the source of any scattering events.</p><p>Proposals to use the ionization-only (<inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>2</mml:mn></mml:math></inline-formula>) signals to search for sub-GeV WIMPs have been made previously <xref ref-type="bibr" rid="c45 c47">[45,47]</xref>, and limits from <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>2</mml:mn></mml:math></inline-formula> observations using XENON10 and XENON100 experiments have been set <xref ref-type="bibr" rid="c35">[35]</xref> (as discussed in the previous section). It is worth noting that the best constraints actually come from the older XENON10 experiment (finished in the year 2011), despite its much smaller detector mass, older generation of detectors, and much smaller total exposure. This is due to the detection strategy of the modern experiments, which rely on the combination of <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>1</mml:mn></mml:math></inline-formula> and <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>2</mml:mn></mml:math></inline-formula> signals.</p><p>The reason <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>2</mml:mn></mml:math></inline-formula> ionization-only signals were considered is because for low-mass WIMPs the typical energy deposited in the detectors is much smaller than the <inline-formula><mml:math display="inline"><mml:mrow><mml:mo>∼</mml:mo><mml:mtext> </mml:mtext><mml:mn>1</mml:mn><mml:mi>–</mml:mi><mml:mn>2</mml:mn><mml:mtext> </mml:mtext><mml:mstyle mathvariant="normal"><mml:mrow><mml:mi>k</mml:mi><mml:mi>e</mml:mi><mml:mi>V</mml:mi></mml:mrow></mml:mstyle></mml:mrow></mml:math></inline-formula> effective low-energy threshold for <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>1</mml:mn></mml:math></inline-formula> signals. It was thus believed that the <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>1</mml:mn></mml:math></inline-formula> scintillation signal produced from such events would be negligible. In this work, we demonstrate that, due to the large enhancement from lower energies and the finite detector resolution, the prompt <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>1</mml:mn></mml:math></inline-formula> scintillation signal can be many times larger than otherwise expected and that it therefore can be a promising WIMP direct detection observable. Thus, it would be possible to perform a low-mass WIMP search with modern liquid xenon detectors using the combined <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>1</mml:mn></mml:math></inline-formula> and <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>2</mml:mn></mml:math></inline-formula> signals. Detailed calculations of the observable <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>2</mml:mn></mml:math></inline-formula> spectrum from low-mass WIMPs was presented recently in Ref. <xref ref-type="bibr" rid="c35">[35]</xref>; here, we present calculations for the corresponding <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>1</mml:mn></mml:math></inline-formula> signal.</p><p>We calculate the potentially observable <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>1</mml:mn></mml:math></inline-formula> (prompt scintillation signal) event rate and modulation amplitude for a hypothetical future liquid xenon detector. We model this detector after that of XENON100 and follow Ref. <xref ref-type="bibr" rid="c54">[54]</xref> for the conversion from the energy deposition to the observable photoelectron (PE) count (see also Ref. <xref ref-type="bibr" rid="c55">[55]</xref>). In this case, the relevant quantity is a counted rate as a function of observable photoelectrons, denoted <inline-formula><mml:math display="inline"><mml:mi>s</mml:mi><mml:mn>1</mml:mn></mml:math></inline-formula>.</p><p>The calculated event rate for the production of <inline-formula><mml:math display="inline"><mml:mi>n</mml:mi></mml:math></inline-formula> photoelectrons is obtained by applying Poisson smearing to the calculated differential rate <xref ref-type="bibr" rid="c54">[54]</xref>. We do this according to a Poisson distribution, <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>P</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>N</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mo>=</mml:mo><mml:msup><mml:mrow><mml:mi>e</mml:mi></mml:mrow><mml:mrow><mml:mo>-</mml:mo><mml:mi>N</mml:mi></mml:mrow></mml:msup><mml:mo stretchy="false">(</mml:mo><mml:msup><mml:mrow><mml:mi>N</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi></mml:mrow></mml:msup><mml:mo stretchy="false">/</mml:mo><mml:mrow><mml:mi>n</mml:mi><mml:mo>!</mml:mo></mml:mrow><mml:mo stretchy="false">)</mml:mo></mml:mrow></mml:math></inline-formula>, where <inline-formula><mml:math display="inline"><mml:mi>N</mml:mi><mml:mo>=</mml:mo><mml:mi>N</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mi>E</mml:mi><mml:mo stretchy="false">)</mml:mo></mml:math></inline-formula> is the expected/average number of photoelectrons produced for a given energy deposition <inline-formula><mml:math display="inline"><mml:mi>E</mml:mi></mml:math></inline-formula> and <inline-formula><mml:math display="inline"><mml:mi>n</mml:mi></mml:math></inline-formula> is the actual number of photoelectrons produced. The relation between the deposited energy (electron recoil energy) and the produced number of photoelectrons is given in Fig. 2 of Ref. <xref ref-type="bibr" rid="c54">[54]</xref>. We model this as a power law, <inline-formula><mml:math display="inline"><mml:mrow><mml:mi>N</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mi>E</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mo>=</mml:mo><mml:mi>a</mml:mi><mml:msup><mml:mrow><mml:mi>E</mml:mi></mml:mrow><mml:mrow><mml:mi>b</mml:mi></mml:mrow></mml:msup></mml:mrow></mml:math></inline-formula>, with <inline-formula><mml:math display="inline"><mml:mi>a</mml:mi><mml:mo>=</mml:mo><mml:mn>1.00</mml:mn><mml:mo stretchy="false">(</mml:mo><mml:mn>25</mml:mn><mml:mo stretchy="false">)</mml:mo></mml:math></inline-formula> and <inline-formula><mml:math display="inline"><mml:mi>a</mml:mi><mml:mo>=</mml:mo><mml:mn>1.53</mml:mn><mml:mo stretchy="false">(</mml:mo><mml:mn>10</mml:mn><mml:mo stretchy="false">)</mml:mo></mml:math></inline-formula>, which give the best fit for the lower energies applicable for this work, accounting for the uncertainties from Ref. <xref ref-type="bibr" rid="c54">[54]</xref>.</p><p>Further, to account for the photomultiplier tube (PMT) detector resolution, we convolve the calculated rate with a Gaussian of standard deviation <inline-formula><mml:math display="inline"><mml:mrow><mml:mi>σ</mml:mi><mml:mo>=</mml:mo><mml:msub><mml:mrow><mml:mi>σ</mml:mi></mml:mrow><mml:mrow><mml:mi>PMT</mml:mi></mml:mrow></mml:msub><mml:msqrt><mml:mrow><mml:mi>n</mml:mi></mml:mrow></mml:msqrt></mml:mrow></mml:math></inline-formula>, with <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>σ</mml:mi></mml:mrow><mml:mrow><mml:mi>PMT</mml:mi></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:mn>0.5</mml:mn><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:mi>PE</mml:mi></mml:mrow></mml:math></inline-formula> <xref ref-type="bibr" rid="c55">[55]</xref>. We do not include uncertainty contributions from the PMT resolution; though, note that we have checked, and error in the <inline-formula><mml:math display="inline"><mml:mi>N</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mi>E</mml:mi><mml:mo stretchy="false">)</mml:mo></mml:math></inline-formula> conversion is by far the dominant source of uncertainty in this step. Finally, the detection acceptance is taken into account as <inline-formula><mml:math display="inline"><mml:mrow><mml:mi>ε</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mi>s</mml:mi><mml:mn>1</mml:mn><mml:mo stretchy="false">)</mml:mo><mml:mo>=</mml:mo><mml:mn>0.88</mml:mn><mml:mo stretchy="false">(</mml:mo><mml:mn>1</mml:mn><mml:mo>-</mml:mo><mml:msup><mml:mrow><mml:mi>e</mml:mi></mml:mrow><mml:mrow><mml:mi>s</mml:mi><mml:mn>1</mml:mn><mml:mo stretchy="false">/</mml:mo><mml:mn>3</mml:mn></mml:mrow></mml:msup><mml:mo stretchy="false">)</mml:mo></mml:mrow></mml:math></inline-formula> <xref ref-type="bibr" rid="c54">[54]</xref>; though, we note that this has an insignificant impact on the results. The final expression for the observable event rate, <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi></mml:math></inline-formula>, as a function of counted PEs <inline-formula><mml:math display="inline"><mml:mi>s</mml:mi><mml:mn>1</mml:mn></mml:math></inline-formula> is <disp-formula id="d12"><mml:math display="block"><mml:mrow><mml:mfrac><mml:mrow><mml:mi mathvariant="normal">d</mml:mi><mml:mi>S</mml:mi></mml:mrow><mml:mrow><mml:mi mathvariant="normal">d</mml:mi><mml:mi>s</mml:mi><mml:mn>1</mml:mn></mml:mrow></mml:mfrac><mml:mo>=</mml:mo><mml:mi>ε</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mi>s</mml:mi><mml:mn>1</mml:mn><mml:mo stretchy="false">)</mml:mo><mml:munder><mml:mrow><mml:mo>∑</mml:mo></mml:mrow><mml:mrow><mml:mi>n</mml:mi></mml:mrow></mml:munder><mml:msub><mml:mrow><mml:mi>g</mml:mi></mml:mrow><mml:mrow><mml:mi>σ</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>n</mml:mi><mml:mo>-</mml:mo><mml:mi>s</mml:mi><mml:mn>1</mml:mn><mml:mo stretchy="false">)</mml:mo><mml:msubsup><mml:mrow><mml:mo>∫</mml:mo></mml:mrow><mml:mrow><mml:mn>0</mml:mn></mml:mrow><mml:mrow><mml:mi>∞</mml:mi></mml:mrow></mml:msubsup><mml:mfrac><mml:mrow><mml:mi mathvariant="normal">d</mml:mi><mml:mi>R</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mi>E</mml:mi><mml:mo stretchy="false">)</mml:mo></mml:mrow><mml:mrow><mml:mi mathvariant="normal">d</mml:mi><mml:mi>E</mml:mi></mml:mrow></mml:mfrac><mml:msub><mml:mrow><mml:mi>P</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>N</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mi mathvariant="normal">d</mml:mi><mml:mi>E</mml:mi><mml:mo>.</mml:mo></mml:mrow></mml:math><label>(12)</label></disp-formula></p><p>We calculate potential event rates, assuming a value for <inline-formula><mml:math display="inline"><mml:msub><mml:mover accent="true"><mml:mi>σ</mml:mi><mml:mo stretchy="false">¯</mml:mo></mml:mover><mml:mi>e</mml:mi></mml:msub></mml:math></inline-formula> that is not excluded by current experiment, for a 1 tonne-year exposure in Fig. <xref ref-type="fig" rid="f5">5</xref> as a function of the WIMP mass, for both a contact and long-range interaction. We show the rate integrated between 3 and 14 PE, as in Ref. <xref ref-type="bibr" rid="c21">[21]</xref> (see also Refs. <xref ref-type="bibr" rid="c18 c20">[18,20]</xref>). This roughly corresponds to the 2–6 keV energy window. The rate is strongly dominated by the lower PE contribution, so it does not matter where the higher PE cut is taken. We also present the expected rates for the ranges including 1 and 2 PE. The larger and less well-understood background at these lower energies makes experiments more difficult to interpret. However, the much enhanced event rate, and large annual modulation amplitudes, may make these regions interesting for future experiments.</p><fig id="f5"><object-id>5</object-id><object-id pub-id-type="doi">10.1103/PhysRevD.100.063017.f5</object-id><label>FIG. 5.</label><caption><p>Hypothetically observable WIMP electron recoil event count expected for a <inline-formula><mml:math display="inline"><mml:mrow><mml:mn>1</mml:mn><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:mi>tonne</mml:mi><mml:mo>·</mml:mo><mml:mi>year</mml:mi></mml:mrow></mml:math></inline-formula> exposure of a liquid xenon detector (based on XENON100) using the prompt scintillation (<inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>1</mml:mn></mml:math></inline-formula>) signal; (<italic>left</italic>) for a contact interaction (with <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mover accent="true"><mml:mrow><mml:mi>σ</mml:mi></mml:mrow><mml:mrow><mml:mo stretchy="false">¯</mml:mo></mml:mrow></mml:mover></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:msup><mml:mrow><mml:mn>10</mml:mn></mml:mrow><mml:mrow><mml:mo>-</mml:mo><mml:mn>38</mml:mn></mml:mrow></mml:msup><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:msup><mml:mrow><mml:mi>cm</mml:mi></mml:mrow><mml:mrow><mml:mo>-</mml:mo><mml:mn>1</mml:mn></mml:mrow></mml:msup></mml:mrow></mml:math></inline-formula>), (<italic>right</italic>) for a contact interaction (with <inline-formula><mml:math display="inline"><mml:msub><mml:mover accent="true"><mml:mi>σ</mml:mi><mml:mo stretchy="false">¯</mml:mo></mml:mover><mml:mi>e</mml:mi></mml:msub><mml:mo>=</mml:mo><mml:mn>4</mml:mn><mml:mo>×</mml:mo><mml:msup><mml:mn>10</mml:mn><mml:mrow><mml:mo>-</mml:mo><mml:mn>35</mml:mn></mml:mrow></mml:msup><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:msup><mml:mrow><mml:mi>cm</mml:mi></mml:mrow><mml:mrow><mml:mo>-</mml:mo><mml:mn>1</mml:mn></mml:mrow></mml:msup></mml:math></inline-formula>). The shaded blue regions show the uncertainties in the calculations. The <inline-formula><mml:math display="inline"><mml:msub><mml:mover accent="true"><mml:mi>σ</mml:mi><mml:mo stretchy="false">¯</mml:mo></mml:mover><mml:mi>e</mml:mi></mml:msub></mml:math></inline-formula> values are chosen to be below the present constraints, which are most stringent around <inline-formula><mml:math display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:mo>∼</mml:mo><mml:mn>0.1</mml:mn><mml:mtext> </mml:mtext><mml:mi>GeV</mml:mi></mml:mrow></mml:math></inline-formula> (see Fig. <xref ref-type="fig" rid="f4">4</xref>). Note that for larger masses the constraints are less stringent, and larger events rates are not ruled out.</p></caption><graphic xlink:href="e063017_5.eps"/></fig><p>In Fig. <xref ref-type="fig" rid="f6">6</xref>, we show the expected annual modulation fraction for the same type of experiment. Due to the strong velocity dependence of the cross section, the fractional modulation amplitude is large. For example, for an approximately 0.1 GeV WIMP, where the event rate may be expected to be high, it is approximately 15%–20%. The peaks in the annual modulation curves (Fig. <xref ref-type="fig" rid="f6">6</xref>) at around 0.04 and 1 GeV are due to the opening of the <inline-formula><mml:math display="inline"><mml:mi>n</mml:mi><mml:mo>=</mml:mo><mml:mn>3</mml:mn></mml:math></inline-formula> and <inline-formula><mml:math display="inline"><mml:mi>n</mml:mi><mml:mo>=</mml:mo><mml:mn>4</mml:mn></mml:math></inline-formula> shells in Xe. Electrons may only become ionized if their binding energies are lower than the maximum kinetic energy of the incident WIMPs: <disp-formula id="d13"><mml:math display="block"><mml:mrow><mml:msub><mml:mrow><mml:mi>I</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:mo>&lt;</mml:mo><mml:msub><mml:mrow><mml:mi>K</mml:mi></mml:mrow><mml:mrow><mml:mi>max</mml:mi></mml:mrow></mml:msub><mml:mo>≃</mml:mo><mml:mfrac><mml:mrow><mml:mn>1</mml:mn></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:mfrac><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:msubsup><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>max</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msubsup><mml:mo>∼</mml:mo><mml:mn>4</mml:mn><mml:mrow><mml:mo>(</mml:mo><mml:mfrac><mml:mrow><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>χ</mml:mi></mml:mrow></mml:msub><mml:msup><mml:mrow><mml:mi>c</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup></mml:mrow><mml:mrow><mml:mi>GeV</mml:mi></mml:mrow></mml:mfrac><mml:mo>)</mml:mo><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:mi>keV</mml:mi><mml:mo>.</mml:mo></mml:mrow></mml:mrow></mml:math><label>(13)</label></disp-formula>The ionization rate for shells with energies close to this number (i.e., that are “only just” accessible) will be sensitive to small changes in the velocity distribution. For Xe, these occur for the <inline-formula><mml:math display="inline"><mml:mi>n</mml:mi><mml:mo>=</mml:mo><mml:mn>3</mml:mn></mml:math></inline-formula> shell just above 1 keV and the <inline-formula><mml:math display="inline"><mml:mi>n</mml:mi><mml:mo>=</mml:mo><mml:mn>4</mml:mn></mml:math></inline-formula> shell just below <inline-formula><mml:math display="inline"><mml:mrow><mml:mn>0.1</mml:mn><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:mi>keV</mml:mi></mml:mrow></mml:math></inline-formula> (see Fig. <xref ref-type="fig" rid="f2">2</xref>).</p><fig id="f6"><object-id>6</object-id><object-id pub-id-type="doi">10.1103/PhysRevD.100.063017.f6</object-id><label>FIG. 6.</label><caption><p>Expected fractional modulation amplitude [<inline-formula><mml:math display="inline"><mml:mrow><mml:mo stretchy="false">(</mml:mo><mml:msup><mml:mrow><mml:mi>S</mml:mi></mml:mrow><mml:mrow><mml:mi>max</mml:mi></mml:mrow></mml:msup><mml:mo>-</mml:mo><mml:mspace linebreak="goodbreak"/><mml:msup><mml:mrow><mml:mi>S</mml:mi></mml:mrow><mml:mrow><mml:mi>min</mml:mi></mml:mrow></mml:msup><mml:mo stretchy="false">)</mml:mo><mml:mo stretchy="false">/</mml:mo><mml:mn>2</mml:mn><mml:msup><mml:mrow><mml:mi>S</mml:mi></mml:mrow><mml:mrow><mml:mi>avg</mml:mi></mml:mrow></mml:msup></mml:mrow></mml:math></inline-formula>] as a function of the WIMP mass, assuming a heavy mediator (<inline-formula><mml:math display="inline"><mml:msub><mml:mi>F</mml:mi><mml:mi>χ</mml:mi></mml:msub><mml:mo>=</mml:mo><mml:mn>1</mml:mn></mml:math></inline-formula>), for the prompt <inline-formula><mml:math display="inline"><mml:mi>S</mml:mi><mml:mn>1</mml:mn></mml:math></inline-formula> signal in a XENON100-like detector, in the 1–, 2–, and 3–14 PE bins. A discussion of the features is given in the text.</p></caption><graphic xlink:href="e063017_6.eps"/></fig></sec><sec id="s5"><label>V.</label><title>CONCLUSION</title><p>We have calculated the expected event rate for atomic ionization by GeV scale WIMPs that scatter off atomic electrons, relevant to the DAMA/LIBRA direct detection experiment. Though the calculated event rate and annual modulation amplitude are much larger than may be expected, we show that such WIMP models cannot explain the observed DAMA modulation signal without conflicting with existing bounds, even when just the lowest-energy 1–2 keV bin is fitted. Taking higher bins into account strengthens this conclusion. Further, we demonstrate explicitly the importance of treating the electron wave functions correctly and note that the expected event rates are extremely sensitive to the detector resolution and low-energy performance and the assumed dark matter velocity distribution. Uncertainties in these quantities lead to large uncertainties in the calculated rates and therefore must be taken into account. Finally, we calculate the potentially observable event rate for the prompt scintillation signal of future liquid xenon detectors. Large event rates would be expected for dark matter parameters which are not excluded by current experimental bounds, making this an important avenue for potential future discovery.</p></sec></body><back><ack><title>ACKNOWLEDGMENTS</title><p>B. M. R. gratefully acknowledges financial support from Labex FIRST-TF. This work was also supported by the Australian Research Council and the Gutenberg Research College fellowship.</p></ack><app-group><app id="app1"><label>APPENDIX:</label><title>ATOMIC IONIZATION FACTOR</title><sec id="app1-s1"><label>1.</label><title>Continuum final states (energy eigenstates)</title><p>For the electron wave functions, we employ the Dirac basis, in which single-particle orbitals are expressed as <disp-formula id="da1"><mml:math display="block"><mml:mrow><mml:mo stretchy="false">⟨</mml:mo><mml:mrow><mml:mi mathvariant="bold-italic">r</mml:mi><mml:mo stretchy="false">|</mml:mo><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi><mml:mi>m</mml:mi></mml:mrow><mml:mo stretchy="false">⟩</mml:mo><mml:mo>=</mml:mo><mml:mfrac><mml:mrow><mml:mn>1</mml:mn></mml:mrow><mml:mrow><mml:mi>r</mml:mi></mml:mrow></mml:mfrac><mml:mrow><mml:mo>(</mml:mo><mml:mtable><mml:mtr><mml:mtd><mml:mrow><mml:msub><mml:mrow><mml:mi>f</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>r</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:msub><mml:mrow><mml:mi mathvariant="normal">Ω</mml:mi></mml:mrow><mml:mrow><mml:mi>j</mml:mi><mml:mi>l</mml:mi><mml:mi>m</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mover accent="true"><mml:mrow><mml:mi mathvariant="bold-italic">n</mml:mi></mml:mrow><mml:mrow><mml:mo stretchy="false">^</mml:mo></mml:mrow></mml:mover><mml:mo stretchy="false">)</mml:mo></mml:mrow></mml:mtd></mml:mtr><mml:mtr><mml:mtd><mml:mrow><mml:mi>i</mml:mi><mml:msub><mml:mrow><mml:mi>g</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>r</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:msub><mml:mrow><mml:mi mathvariant="normal">Ω</mml:mi></mml:mrow><mml:mrow><mml:mi>j</mml:mi><mml:mover accent="true"><mml:mrow><mml:mi>l</mml:mi></mml:mrow><mml:mrow><mml:mo accent="true" stretchy="false">˜</mml:mo></mml:mrow></mml:mover><mml:mi>m</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mover accent="true"><mml:mrow><mml:mi mathvariant="bold-italic">n</mml:mi></mml:mrow><mml:mrow><mml:mo stretchy="false">^</mml:mo></mml:mrow></mml:mover><mml:mo stretchy="false">)</mml:mo></mml:mrow></mml:mtd></mml:mtr></mml:mtable><mml:mo>)</mml:mo></mml:mrow><mml:mo>,</mml:mo></mml:mrow></mml:math><label>(A1)</label></disp-formula>where <inline-formula><mml:math display="inline"><mml:mi mathvariant="normal">Ω</mml:mi></mml:math></inline-formula> is a spherical spinor, <disp-formula id="da2"><mml:math display="block"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">Ω</mml:mi></mml:mrow><mml:mrow><mml:mi>j</mml:mi><mml:mi>l</mml:mi><mml:mi>m</mml:mi></mml:mrow></mml:msub><mml:mo>≡</mml:mo><mml:munder><mml:mrow><mml:mo>∑</mml:mo></mml:mrow><mml:mrow><mml:mi>σ</mml:mi></mml:mrow></mml:munder><mml:mrow><mml:mo stretchy="false">⟨</mml:mo><mml:mrow><mml:mi>l</mml:mi><mml:mo>,</mml:mo><mml:mi>m</mml:mi><mml:mo>-</mml:mo><mml:mi>σ</mml:mi><mml:mo>,</mml:mo><mml:mn>1</mml:mn><mml:mo stretchy="false">/</mml:mo><mml:mn>2</mml:mn><mml:mo>,</mml:mo><mml:mi>σ</mml:mi><mml:mo stretchy="false">|</mml:mo><mml:mi>j</mml:mi><mml:mo>,</mml:mo><mml:mi>m</mml:mi></mml:mrow><mml:mo stretchy="false">⟩</mml:mo></mml:mrow><mml:msub><mml:mrow><mml:mi>Y</mml:mi></mml:mrow><mml:mrow><mml:mi>l</mml:mi><mml:mo>,</mml:mo><mml:mi>m</mml:mi><mml:mo>-</mml:mo><mml:mi>σ</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mover accent="true"><mml:mrow><mml:mi mathvariant="bold-italic">n</mml:mi></mml:mrow><mml:mrow><mml:mo stretchy="false">^</mml:mo></mml:mrow></mml:mover><mml:mo stretchy="false">)</mml:mo><mml:msub><mml:mrow><mml:mi>χ</mml:mi></mml:mrow><mml:mrow><mml:mi>σ</mml:mi></mml:mrow></mml:msub><mml:mo>,</mml:mo></mml:mrow></mml:math><label>(A2)</label></disp-formula>with <inline-formula><mml:math display="inline"><mml:mrow><mml:mo stretchy="false">⟨</mml:mo><mml:mrow><mml:msub><mml:mrow><mml:mi>j</mml:mi></mml:mrow><mml:mrow><mml:mn>1</mml:mn></mml:mrow></mml:msub><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mn>1</mml:mn></mml:mrow></mml:msub><mml:msub><mml:mrow><mml:mi>j</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub><mml:mo stretchy="false">|</mml:mo><mml:mi>J</mml:mi><mml:mi>M</mml:mi></mml:mrow><mml:mo stretchy="false">⟩</mml:mo></mml:mrow></mml:math></inline-formula> a Clebsch-Gordon coefficient, <inline-formula><mml:math display="inline"><mml:msub><mml:mi>Y</mml:mi><mml:mrow><mml:mi>l</mml:mi><mml:mi>m</mml:mi></mml:mrow></mml:msub></mml:math></inline-formula> a spherical harmonic, <inline-formula><mml:math display="inline"><mml:mover accent="true"><mml:mi>l</mml:mi><mml:mo accent="true" stretchy="false">˜</mml:mo></mml:mover><mml:mo>=</mml:mo><mml:mi>l</mml:mi><mml:mo>±</mml:mo><mml:mn>1</mml:mn></mml:math></inline-formula> for <inline-formula><mml:math display="inline"><mml:mi>j</mml:mi><mml:mo>=</mml:mo><mml:mi>l</mml:mi><mml:mo>±</mml:mo><mml:mn>1</mml:mn><mml:mo stretchy="false">/</mml:mo><mml:mn>2</mml:mn></mml:math></inline-formula>, and <inline-formula><mml:math display="inline"><mml:msub><mml:mi>χ</mml:mi><mml:mi>σ</mml:mi></mml:msub></mml:math></inline-formula> a spin eigenstate with <inline-formula><mml:math display="inline"><mml:mi>σ</mml:mi><mml:mo>=</mml:mo><mml:mo>±</mml:mo><mml:mn>1</mml:mn><mml:mo stretchy="false">/</mml:mo><mml:mn>2</mml:mn></mml:math></inline-formula> being the spin orientation. Note, that in the nonrelativistic limit the small component <inline-formula><mml:math display="inline"><mml:mi>g</mml:mi><mml:mo stretchy="false">→</mml:mo><mml:mn>0</mml:mn></mml:math></inline-formula>, and <inline-formula><mml:math display="inline"><mml:mi>f</mml:mi><mml:mo stretchy="false">→</mml:mo><mml:mi>P</mml:mi></mml:math></inline-formula>, where <inline-formula><mml:math display="inline"><mml:mi>P</mml:mi><mml:mo stretchy="false">/</mml:mo><mml:mi>r</mml:mi></mml:math></inline-formula> is the radial solution to the nonrelativistic Schrödinger equation. To reach nonrelativistic limit in the calculations, we allow the speed of light <inline-formula><mml:math display="inline"><mml:mi>c</mml:mi><mml:mo stretchy="false">→</mml:mo><mml:mi>∞</mml:mi></mml:math></inline-formula> inside the code before the Dirac equation is solved. We also note that the relativistic enhancement discussed in the main text does not stem from the lower <inline-formula><mml:math display="inline"><mml:mi>g</mml:mi></mml:math></inline-formula> component, the contributions to <inline-formula><mml:math display="inline"><mml:mi>R</mml:mi></mml:math></inline-formula> of which scale as <inline-formula><mml:math display="inline"><mml:mo stretchy="false">(</mml:mo><mml:mi>Z</mml:mi><mml:mi>α</mml:mi><mml:msup><mml:mo stretchy="false">)</mml:mo><mml:mn>2</mml:mn></mml:msup></mml:math></inline-formula> (except in the case of pseudoscalar/pseudovector interactions, where the <inline-formula><mml:math display="inline"><mml:mi>g</mml:mi></mml:math></inline-formula> functions contribute at leading order <xref ref-type="bibr" rid="c17">[17]</xref>). Instead, they come from differences in the radial dependence of the upper <inline-formula><mml:math display="inline"><mml:mi>f</mml:mi></mml:math></inline-formula> component <xref ref-type="bibr" rid="c26">[26]</xref>.</p><p>The continuum state orbitals are defined similarly, <disp-formula id="da3"><mml:math display="block"><mml:mrow><mml:mo stretchy="false">⟨</mml:mo><mml:mrow><mml:mi mathvariant="bold-italic">r</mml:mi><mml:mo stretchy="false">|</mml:mo><mml:mi>ϵ</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi><mml:mi>m</mml:mi></mml:mrow><mml:mo stretchy="false">⟩</mml:mo><mml:mo>=</mml:mo><mml:mfrac><mml:mrow><mml:mn>1</mml:mn></mml:mrow><mml:mrow><mml:mi>r</mml:mi></mml:mrow></mml:mfrac><mml:mrow><mml:mo>(</mml:mo><mml:mtable><mml:mtr><mml:mtd><mml:mrow><mml:msub><mml:mrow><mml:mi>f</mml:mi></mml:mrow><mml:mrow><mml:mi>ϵ</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>r</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:msub><mml:mrow><mml:mi mathvariant="normal">Ω</mml:mi></mml:mrow><mml:mrow><mml:mi>j</mml:mi><mml:mi>l</mml:mi><mml:mi>m</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mover accent="true"><mml:mrow><mml:mi mathvariant="bold-italic">n</mml:mi></mml:mrow><mml:mrow><mml:mo stretchy="false">^</mml:mo></mml:mrow></mml:mover><mml:mo stretchy="false">)</mml:mo></mml:mrow></mml:mtd></mml:mtr><mml:mtr><mml:mtd><mml:mrow><mml:mi>i</mml:mi><mml:msub><mml:mrow><mml:mi>g</mml:mi></mml:mrow><mml:mrow><mml:mi>ϵ</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>r</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:msub><mml:mrow><mml:mi mathvariant="normal">Ω</mml:mi></mml:mrow><mml:mrow><mml:mi>j</mml:mi><mml:mover accent="true"><mml:mrow><mml:mi>l</mml:mi></mml:mrow><mml:mrow><mml:mo accent="true" stretchy="false">˜</mml:mo></mml:mrow></mml:mover><mml:mi>m</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mover accent="true"><mml:mrow><mml:mi mathvariant="bold-italic">n</mml:mi></mml:mrow><mml:mrow><mml:mo stretchy="false">^</mml:mo></mml:mrow></mml:mover><mml:mo stretchy="false">)</mml:mo></mml:mrow></mml:mtd></mml:mtr></mml:mtable><mml:mo>)</mml:mo></mml:mrow><mml:mo>,</mml:mo></mml:mrow></mml:math><label>(A3)</label></disp-formula>with energy normalization <xref ref-type="bibr" rid="c56">[56]</xref>, so that <disp-formula id="da4"><mml:math display="block"><mml:mrow><mml:msubsup><mml:mrow><mml:mo>∫</mml:mo></mml:mrow><mml:mrow><mml:mi>ϵ</mml:mi><mml:mo>-</mml:mo><mml:mi>δ</mml:mi><mml:mi>ϵ</mml:mi></mml:mrow><mml:mrow><mml:mi>ϵ</mml:mi><mml:mo>+</mml:mo><mml:mi>δ</mml:mi><mml:mi>ϵ</mml:mi></mml:mrow></mml:msubsup><mml:mrow><mml:mo stretchy="false">⟨</mml:mo><mml:mrow><mml:msup><mml:mrow><mml:mi>ϵ</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:mi>j</mml:mi><mml:mi>l</mml:mi><mml:mi>m</mml:mi><mml:mo stretchy="false">|</mml:mo><mml:mi>ϵ</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi><mml:mi>m</mml:mi></mml:mrow><mml:mo stretchy="false">⟩</mml:mo></mml:mrow><mml:mi mathvariant="normal">d</mml:mi><mml:msup><mml:mrow><mml:mi>ϵ</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:mo>=</mml:mo><mml:mn>1</mml:mn><mml:mo>.</mml:mo></mml:mrow></mml:math><label>(A4)</label></disp-formula>In practice, the normalization is achieved by a comparison with analytic Coulomb functions at large <inline-formula><mml:math display="inline"><mml:mi>r</mml:mi></mml:math></inline-formula> <xref ref-type="bibr" rid="c56">[56]</xref>. Note, this formalism means that <inline-formula><mml:math display="inline"><mml:msub><mml:mi>ϱ</mml:mi><mml:mi>f</mml:mi></mml:msub></mml:math></inline-formula> <xref ref-type="disp-formula" rid="d3">(3)</xref> is included already in the definition of the orbitals <inline-formula><mml:math display="inline"><mml:mrow><mml:mo stretchy="false">⟨</mml:mo><mml:mrow><mml:mi mathvariant="bold-italic">r</mml:mi><mml:mo stretchy="false">|</mml:mo><mml:mi>ϵ</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi><mml:mi>m</mml:mi></mml:mrow><mml:mo stretchy="false">⟩</mml:mo></mml:mrow></mml:math></inline-formula>, which have dimension <inline-formula><mml:math display="inline"><mml:mrow><mml:mo stretchy="false">[</mml:mo><mml:mtext>Length</mml:mtext><mml:msup><mml:mrow><mml:mo stretchy="false">]</mml:mo></mml:mrow><mml:mrow><mml:mo>-</mml:mo><mml:mn>3</mml:mn><mml:mo stretchy="false">/</mml:mo><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:mo stretchy="false">[</mml:mo><mml:mtext>Energy</mml:mtext><mml:msup><mml:mrow><mml:mo stretchy="false">]</mml:mo></mml:mrow><mml:mrow><mml:mo>-</mml:mo><mml:mn>1</mml:mn><mml:mo stretchy="false">/</mml:mo><mml:mn>2</mml:mn></mml:mrow></mml:msup></mml:mrow></mml:math></inline-formula>.</p><p>To calculate the atomic ionization factor, we first expand the exponential in Eq. <xref ref-type="disp-formula" rid="d3">(3)</xref> as a sum over irreducible spherical tensors: <inline-formula><mml:math display="inline"><mml:mrow><mml:msup><mml:mrow><mml:mi>e</mml:mi></mml:mrow><mml:mrow><mml:mi>i</mml:mi><mml:mi mathvariant="bold-italic">q</mml:mi><mml:mo>·</mml:mo><mml:mi mathvariant="bold-italic">r</mml:mi></mml:mrow></mml:msup><mml:mo>=</mml:mo><mml:msubsup><mml:mrow><mml:mo>∑</mml:mo></mml:mrow><mml:mrow><mml:mi>L</mml:mi><mml:mo>=</mml:mo><mml:mn>0</mml:mn></mml:mrow><mml:mrow><mml:mi>∞</mml:mi></mml:mrow></mml:msubsup><mml:msubsup><mml:mrow><mml:mo>∑</mml:mo></mml:mrow><mml:mrow><mml:mi>M</mml:mi><mml:mo>=</mml:mo><mml:mo>-</mml:mo><mml:mi>L</mml:mi></mml:mrow><mml:mrow><mml:mi>L</mml:mi></mml:mrow></mml:msubsup><mml:msub><mml:mrow><mml:mi>T</mml:mi></mml:mrow><mml:mrow><mml:mi>L</mml:mi><mml:mi>M</mml:mi></mml:mrow></mml:msub></mml:mrow></mml:math></inline-formula> (see, e.g., Ref. <xref ref-type="bibr" rid="c57">[57]</xref>). Then, from the standard rules for angular momentum, the atomic factor can be expressed as <disp-formula id="da5"><mml:math display="block"><mml:mrow><mml:msub><mml:mrow><mml:mi>K</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>E</mml:mi><mml:mo>,</mml:mo><mml:mi>q</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mo>=</mml:mo><mml:msub><mml:mrow><mml:mi>E</mml:mi></mml:mrow><mml:mrow><mml:mi>H</mml:mi></mml:mrow></mml:msub><mml:munder><mml:mrow><mml:mo>∑</mml:mo></mml:mrow><mml:mrow><mml:mi>L</mml:mi></mml:mrow></mml:munder><mml:munder><mml:mrow><mml:mo>∑</mml:mo></mml:mrow><mml:mrow><mml:msup><mml:mrow><mml:mi>j</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:msup><mml:mrow><mml:mi>l</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup></mml:mrow></mml:munder><mml:mo stretchy="false">|</mml:mo><mml:msubsup><mml:mrow><mml:mi>R</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow><mml:mrow><mml:msup><mml:mrow><mml:mi>j</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:msup><mml:mrow><mml:mi>l</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:mi>L</mml:mi></mml:mrow></mml:msubsup><mml:mo stretchy="false">(</mml:mo><mml:mi>ϵ</mml:mi><mml:mo>,</mml:mo><mml:mi>q</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:msup><mml:mrow><mml:mo stretchy="false">|</mml:mo></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:msubsup><mml:mrow><mml:mi>C</mml:mi></mml:mrow><mml:mrow><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow><mml:mrow><mml:msup><mml:mrow><mml:mi>j</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:msup><mml:mrow><mml:mi>l</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:mi>L</mml:mi></mml:mrow></mml:msubsup><mml:mo>.</mml:mo></mml:mrow></mml:math><label>(A5)</label></disp-formula>Here, <inline-formula><mml:math display="inline"><mml:mi>R</mml:mi></mml:math></inline-formula> is the radial integral <disp-formula id="da6"><mml:math display="block"><mml:mrow><mml:msubsup><mml:mrow><mml:mi>R</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow><mml:mrow><mml:msup><mml:mrow><mml:mi>j</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:msup><mml:mrow><mml:mi>l</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:mi>L</mml:mi></mml:mrow></mml:msubsup><mml:mo stretchy="false">(</mml:mo><mml:mi>ϵ</mml:mi><mml:mo>,</mml:mo><mml:mi>q</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mo>=</mml:mo><mml:msubsup><mml:mrow><mml:mo>∫</mml:mo></mml:mrow><mml:mrow><mml:mn>0</mml:mn></mml:mrow><mml:mrow><mml:mi>∞</mml:mi></mml:mrow></mml:msubsup><mml:mo stretchy="false">[</mml:mo><mml:msub><mml:mrow><mml:mi>f</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>r</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:msub><mml:mrow><mml:mi>f</mml:mi></mml:mrow><mml:mrow><mml:mi>ϵ</mml:mi><mml:msup><mml:mrow><mml:mi>j</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:msup><mml:mrow><mml:mi>l</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>r</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mo>+</mml:mo><mml:msub><mml:mrow><mml:mi>g</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>r</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:msub><mml:mrow><mml:mi>g</mml:mi></mml:mrow><mml:mrow><mml:mi>ϵ</mml:mi><mml:msup><mml:mrow><mml:mi>j</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:msup><mml:mrow><mml:mi>l</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>r</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mo stretchy="false">]</mml:mo><mml:msub><mml:mrow><mml:mi>j</mml:mi></mml:mrow><mml:mrow><mml:mi>L</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>q</mml:mi><mml:mi>r</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mi mathvariant="normal">d</mml:mi><mml:mi>r</mml:mi><mml:mo>,</mml:mo><mml:mspace linebreak="goodbreak"/><mml:malignmark/></mml:mrow></mml:math><label>(A6)</label></disp-formula>where <inline-formula><mml:math display="inline"><mml:mrow><mml:mrow><mml:mi>ϵ</mml:mi><mml:mo>=</mml:mo><mml:msub><mml:mrow><mml:mi>I</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:mo>-</mml:mo><mml:mi>E</mml:mi></mml:mrow><mml:mo>,</mml:mo><mml:msub><mml:mrow><mml:mi>j</mml:mi></mml:mrow><mml:mrow><mml:mi>l</mml:mi></mml:mrow></mml:msub></mml:mrow></mml:math></inline-formula> is a spherical Bessel function and <inline-formula><mml:math display="inline"><mml:mi>C</mml:mi></mml:math></inline-formula> is an angular coefficient given by (for closed shells) <disp-formula id="da7"><mml:math display="block"><mml:mrow><mml:msubsup><mml:mrow><mml:mi>C</mml:mi></mml:mrow><mml:mrow><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow><mml:mrow><mml:msup><mml:mrow><mml:mi>j</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:msup><mml:mrow><mml:mi>l</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:mi>L</mml:mi></mml:mrow></mml:msubsup><mml:mo>=</mml:mo><mml:mo stretchy="false">[</mml:mo><mml:mi>j</mml:mi><mml:mo stretchy="false">]</mml:mo><mml:mo stretchy="false">[</mml:mo><mml:msup><mml:mrow><mml:mi>j</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:mo stretchy="false">]</mml:mo><mml:mo stretchy="false">[</mml:mo><mml:mi>L</mml:mi><mml:mo stretchy="false">]</mml:mo><mml:msup><mml:mrow><mml:mo>(</mml:mo><mml:mtable><mml:mtr><mml:mtd><mml:mi>j</mml:mi></mml:mtd><mml:mtd><mml:msup><mml:mrow><mml:mi>j</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup></mml:mtd><mml:mtd><mml:mi>L</mml:mi></mml:mtd></mml:mtr><mml:mtr><mml:mtd><mml:mrow><mml:mo>-</mml:mo><mml:mn>1</mml:mn><mml:mo stretchy="false">/</mml:mo><mml:mn>2</mml:mn></mml:mrow></mml:mtd><mml:mtd><mml:mrow><mml:mn>1</mml:mn><mml:mo stretchy="false">/</mml:mo><mml:mn>2</mml:mn></mml:mrow></mml:mtd><mml:mtd><mml:mn>0</mml:mn></mml:mtd></mml:mtr></mml:mtable><mml:mo>)</mml:mo></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:msubsup><mml:mrow><mml:mi mathvariant="normal">Π</mml:mi></mml:mrow><mml:mrow><mml:mi>l</mml:mi><mml:msup><mml:mrow><mml:mi>l</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup></mml:mrow><mml:mrow><mml:mi>L</mml:mi></mml:mrow></mml:msubsup><mml:mo>,</mml:mo></mml:mrow></mml:math><label>(A7)</label></disp-formula>with <inline-formula><mml:math display="inline"><mml:mrow><mml:mo stretchy="false">[</mml:mo><mml:mi>J</mml:mi><mml:mo stretchy="false">]</mml:mo><mml:mo>≡</mml:mo><mml:mn>2</mml:mn><mml:mi>J</mml:mi><mml:mo>+</mml:mo><mml:mn>1</mml:mn><mml:mo>,</mml:mo><mml:mo stretchy="false">(</mml:mo><mml:mo>…</mml:mo><mml:mo stretchy="false">)</mml:mo></mml:mrow></mml:math></inline-formula> being a Wigner <inline-formula><mml:math display="inline"><mml:mn>3</mml:mn><mml:mi>j</mml:mi></mml:math></inline-formula> symbol, and <inline-formula><mml:math display="inline"><mml:mrow><mml:msubsup><mml:mrow><mml:mi mathvariant="normal">Π</mml:mi></mml:mrow><mml:mrow><mml:mi>l</mml:mi><mml:msup><mml:mrow><mml:mi>l</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup></mml:mrow><mml:mrow><mml:mi>L</mml:mi></mml:mrow></mml:msubsup><mml:mo>=</mml:mo><mml:mn>1</mml:mn></mml:mrow></mml:math></inline-formula> if <inline-formula><mml:math display="inline"><mml:mi>l</mml:mi><mml:mo>+</mml:mo><mml:msup><mml:mi>l</mml:mi><mml:mo>′</mml:mo></mml:msup><mml:mo>+</mml:mo><mml:mi>L</mml:mi></mml:math></inline-formula> is even and is 0 otherwise. The primed quantities refer to the angular momentum state of the ejected ionization electron (final state). For <inline-formula><mml:math display="inline"><mml:mrow><mml:mi>q</mml:mi><mml:mo>≳</mml:mo><mml:mn>1</mml:mn><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:mi>MeV</mml:mi></mml:mrow></mml:math></inline-formula>, only the <inline-formula><mml:math display="inline"><mml:mi>L</mml:mi><mml:mo>=</mml:mo><mml:mn>0</mml:mn></mml:math></inline-formula> term contributes significantly, while for <inline-formula><mml:math display="inline"><mml:mrow><mml:mi>q</mml:mi><mml:mo>≲</mml:mo><mml:mn>0.01</mml:mn><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:mi>MeV</mml:mi></mml:mrow></mml:math></inline-formula>, only the <inline-formula><mml:math display="inline"><mml:mi>L</mml:mi><mml:mo>=</mml:mo><mml:mn>1</mml:mn></mml:math></inline-formula> term is important. For the intermediate region approximately 0.1 MeV, the sum saturates reasonably rapidly, and convergence is reached by <inline-formula><mml:math display="inline"><mml:mi>L</mml:mi><mml:mo>=</mml:mo><mml:mn>4</mml:mn></mml:math></inline-formula>. These equations are valid for the case of DM that interacts via vector and scalar mediators; similar expressions for the case of pseudovector and pseudoscalar mediators are given in Ref. <xref ref-type="bibr" rid="c17">[17]</xref>.</p><p>Plots of the atomic ionization factors showing the energy and momentum-transfer dependence, as well as the contributions from different atomic orbitals, are shown in Fig. <xref ref-type="fig" rid="f7">7</xref>.</p><fig id="f7"><object-id>7</object-id><object-id pub-id-type="doi">10.1103/PhysRevD.100.063017.f7</object-id><label>FIG. 7.</label><caption><p>The left panel shows the dominating contributions to the atomic ionization factor <inline-formula><mml:math display="inline"><mml:mi>K</mml:mi></mml:math></inline-formula> for <inline-formula><mml:math display="inline"><mml:mi>E</mml:mi><mml:mo>=</mml:mo><mml:mn>0.5</mml:mn><mml:mtext> </mml:mtext><mml:mtext> </mml:mtext><mml:mi>keV</mml:mi></mml:math></inline-formula>. For a given energy, <inline-formula><mml:math display="inline"><mml:mi>K</mml:mi></mml:math></inline-formula> is dominated by the deepest accessible shell (lowest principal quantum number <inline-formula><mml:math display="inline"><mml:mi>n</mml:mi></mml:math></inline-formula>). The solid black line is the total sum (including states with higher <inline-formula><mml:math display="inline"><mml:mi>n</mml:mi></mml:math></inline-formula> that are not shown explicitly). The main contribution at low <inline-formula><mml:math display="inline"><mml:mi>q</mml:mi></mml:math></inline-formula> comes from the states with highest total angular momentum <inline-formula><mml:math display="inline"><mml:mi>j</mml:mi></mml:math></inline-formula>, while the main large <inline-formula><mml:math display="inline"><mml:mi>q</mml:mi></mml:math></inline-formula> contribution comes from states with the lowest orbital momentum <inline-formula><mml:math display="inline"><mml:mi>l</mml:mi></mml:math></inline-formula>. The right panel shows the total <inline-formula><mml:math display="inline"><mml:mi>K</mml:mi></mml:math></inline-formula> (summed over all accessible atomic electrons) for <inline-formula><mml:math display="inline"><mml:mrow><mml:mi>E</mml:mi><mml:mo>=</mml:mo><mml:mn>0.03</mml:mn><mml:mo>,</mml:mo><mml:mn>0.5</mml:mn></mml:mrow></mml:math></inline-formula>, and 2 keV, which are dominated by the <inline-formula><mml:math display="inline"><mml:mrow><mml:mi>n</mml:mi><mml:mo>=</mml:mo><mml:mn>5</mml:mn><mml:mo>,</mml:mo><mml:mn>4</mml:mn></mml:mrow></mml:math></inline-formula>, and 3 shells, respectively.</p></caption><graphic xlink:href="e063017_7.eps"/></fig></sec><sec id="app1-s2"><label>2.</label><title>Plane-wave final states</title><p>Here, we present the formulas for calculating the ionization assuming a plane-wave final state. This is done only as a demonstration; we stress, as discussed above, that this is not a reasonable approximation for the processes considered in this work. Take the final ionization electron state as a plane wave, <disp-formula id="da8"><mml:math display="block"><mml:mrow><mml:mrow><mml:mo stretchy="false">⟨</mml:mo><mml:mrow><mml:mi mathvariant="bold-italic">r</mml:mi><mml:mo stretchy="false">|</mml:mo><mml:mi mathvariant="bold-italic">p</mml:mi></mml:mrow><mml:mo stretchy="false">⟩</mml:mo></mml:mrow><mml:mo>=</mml:mo><mml:msup><mml:mrow><mml:mi>e</mml:mi></mml:mrow><mml:mrow><mml:mi>i</mml:mi><mml:mi mathvariant="bold-italic">p</mml:mi><mml:mo>·</mml:mo><mml:mi mathvariant="bold-italic">r</mml:mi><mml:mo stretchy="false">/</mml:mo><mml:mo>ℏ</mml:mo></mml:mrow></mml:msup><mml:mo>,</mml:mo></mml:mrow></mml:math><label>(A8)</label></disp-formula>with <inline-formula><mml:math display="inline"><mml:mo stretchy="false">|</mml:mo><mml:mi>p</mml:mi><mml:mo stretchy="false">|</mml:mo><mml:mo>=</mml:mo><mml:msqrt><mml:mrow><mml:mn>2</mml:mn><mml:msub><mml:mi>m</mml:mi><mml:mi>e</mml:mi></mml:msub><mml:mi>ϵ</mml:mi></mml:mrow></mml:msqrt></mml:math></inline-formula>, subject to the normalization <disp-formula id="und2"><mml:math display="block"><mml:mrow><mml:mo>∫</mml:mo><mml:mfrac><mml:mrow><mml:msup><mml:mrow><mml:mi mathvariant="normal">d</mml:mi></mml:mrow><mml:mrow><mml:mn>3</mml:mn></mml:mrow></mml:msup><mml:mi mathvariant="bold-italic">p</mml:mi></mml:mrow><mml:mrow><mml:mo stretchy="false">(</mml:mo><mml:mn>2</mml:mn><mml:mi>π</mml:mi><mml:mo>ℏ</mml:mo><mml:msup><mml:mrow><mml:mo stretchy="false">)</mml:mo></mml:mrow><mml:mrow><mml:mn>3</mml:mn></mml:mrow></mml:msup></mml:mrow></mml:mfrac><mml:mrow><mml:mo stretchy="false">⟨</mml:mo><mml:mrow><mml:mi mathvariant="bold-italic">p</mml:mi><mml:mo stretchy="false">|</mml:mo><mml:mi mathvariant="bold-italic">p</mml:mi></mml:mrow><mml:mo stretchy="false">⟩</mml:mo></mml:mrow><mml:mo>=</mml:mo><mml:mn>1</mml:mn><mml:mo>.</mml:mo></mml:mrow></mml:math></disp-formula>The relativistic corrections to <xref ref-type="disp-formula" rid="da8">(A8)</xref> are suppressed as <inline-formula><mml:math display="inline"><mml:msqrt><mml:mrow><mml:mi>ϵ</mml:mi><mml:mo stretchy="false">/</mml:mo><mml:mo stretchy="false">(</mml:mo><mml:mn>2</mml:mn><mml:msub><mml:mi>m</mml:mi><mml:mi>e</mml:mi></mml:msub><mml:msup><mml:mi>c</mml:mi><mml:mn>2</mml:mn></mml:msup><mml:mo stretchy="false">)</mml:mo></mml:mrow></mml:msqrt></mml:math></inline-formula> and can be safely excluded. If <inline-formula><mml:math display="inline"><mml:mo>ℏ</mml:mo><mml:mi mathvariant="bold-italic">k</mml:mi></mml:math></inline-formula> (<inline-formula><mml:math display="inline"><mml:mrow><mml:mo>ℏ</mml:mo><mml:msup><mml:mrow><mml:mi mathvariant="bold-italic">k</mml:mi></mml:mrow><mml:mrow><mml:mo mathvariant="bold">′</mml:mo></mml:mrow></mml:msup></mml:mrow></mml:math></inline-formula>) is the initial (final) WIMP momentum, the minimum allowable momentum transfer can be expressed as <inline-formula><mml:math display="inline"><mml:mrow><mml:mo>ℏ</mml:mo><mml:msub><mml:mrow><mml:mi>q</mml:mi></mml:mrow><mml:mrow><mml:mo>-</mml:mo></mml:mrow></mml:msub><mml:mo>=</mml:mo><mml:mspace linebreak="goodbreak"/><mml:mo>ℏ</mml:mo><mml:mo stretchy="false">|</mml:mo><mml:msup><mml:mrow><mml:mi mathvariant="bold-italic">k</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:mo>-</mml:mo><mml:mi mathvariant="bold-italic">k</mml:mi><mml:mo stretchy="false">|</mml:mo><mml:mo>≈</mml:mo><mml:mi>E</mml:mi><mml:mo stretchy="false">/</mml:mo><mml:mi>v</mml:mi><mml:mo>≳</mml:mo><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow></mml:msub><mml:msubsup><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msubsup><mml:mo stretchy="false">/</mml:mo><mml:mi>v</mml:mi><mml:mo>=</mml:mo><mml:msub><mml:mrow><mml:mi>p</mml:mi></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:msub><mml:mrow><mml:mi>v</mml:mi></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">/</mml:mo><mml:mi>v</mml:mi><mml:mo stretchy="false">)</mml:mo></mml:mrow></mml:math></inline-formula>. Since for inner-shell electrons <inline-formula><mml:math display="inline"><mml:msub><mml:mi>v</mml:mi><mml:mi>e</mml:mi></mml:msub><mml:mo>∼</mml:mo><mml:mi>Z</mml:mi><mml:mi>α</mml:mi><mml:mi>c</mml:mi></mml:math></inline-formula>, while the DM speed <inline-formula><mml:math display="inline"><mml:mi>v</mml:mi><mml:mo>∼</mml:mo><mml:msup><mml:mn>10</mml:mn><mml:mrow><mml:mo>-</mml:mo><mml:mn>3</mml:mn></mml:mrow></mml:msup><mml:mi>c</mml:mi></mml:math></inline-formula>, this implies <inline-formula><mml:math display="inline"><mml:mo>ℏ</mml:mo><mml:mi>q</mml:mi><mml:mo>≫</mml:mo><mml:msub><mml:mi>p</mml:mi><mml:mi>e</mml:mi></mml:msub></mml:math></inline-formula>. Then, the form factor can be expressed as <disp-formula id="da9"><mml:math display="block"><mml:mrow><mml:msubsup><mml:mrow><mml:mi>K</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow><mml:mrow><mml:mi>pw</mml:mi></mml:mrow></mml:msubsup><mml:mo>=</mml:mo><mml:mfrac><mml:mrow><mml:mn>2</mml:mn><mml:msub><mml:mrow><mml:mi>E</mml:mi></mml:mrow><mml:mrow><mml:mi>H</mml:mi></mml:mrow></mml:msub></mml:mrow><mml:mrow><mml:mi>π</mml:mi></mml:mrow></mml:mfrac><mml:mo stretchy="false">|</mml:mo><mml:msub><mml:mrow><mml:mi mathvariant="normal">Φ</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>q</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:msup><mml:mrow><mml:mo stretchy="false">|</mml:mo></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup><mml:msqrt><mml:mrow><mml:mfrac><mml:mrow><mml:mn>2</mml:mn><mml:msubsup><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow><mml:mrow><mml:mn>3</mml:mn></mml:mrow></mml:msubsup><mml:mo stretchy="false">(</mml:mo><mml:mi>E</mml:mi><mml:mo>-</mml:mo><mml:msub><mml:mrow><mml:mi>I</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">)</mml:mo></mml:mrow><mml:mrow><mml:msup><mml:mrow><mml:mo>ℏ</mml:mo></mml:mrow><mml:mrow><mml:mn>3</mml:mn></mml:mrow></mml:msup></mml:mrow></mml:mfrac></mml:mrow></mml:msqrt><mml:mo stretchy="false">(</mml:mo><mml:mn>2</mml:mn><mml:mi>j</mml:mi><mml:mo>+</mml:mo><mml:mn>1</mml:mn><mml:mo stretchy="false">)</mml:mo><mml:mo>,</mml:mo></mml:mrow></mml:math><label>(A9)</label></disp-formula>with the radial integral defined as <disp-formula id="da10"><mml:math display="block"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">Φ</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>q</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mo>=</mml:mo><mml:msubsup><mml:mrow><mml:mo>∫</mml:mo></mml:mrow><mml:mrow><mml:mn>0</mml:mn></mml:mrow><mml:mrow><mml:mi>∞</mml:mi></mml:mrow></mml:msubsup><mml:msub><mml:mrow><mml:mi>f</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:mi>j</mml:mi><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>r</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:msub><mml:mrow><mml:mi>j</mml:mi></mml:mrow><mml:mrow><mml:mi>l</mml:mi></mml:mrow></mml:msub><mml:mo stretchy="false">(</mml:mo><mml:mi>q</mml:mi><mml:mi>r</mml:mi><mml:mo stretchy="false">)</mml:mo><mml:mi>r</mml:mi><mml:mi mathvariant="normal">d</mml:mi><mml:mi>r</mml:mi><mml:mo>.</mml:mo></mml:mrow></mml:math><label>(A10)</label></disp-formula>This method of calculating the event rate is used widely in the literature; however, for large values of <inline-formula><mml:math display="inline"><mml:mi>q</mml:mi></mml:math></inline-formula>, it can drastically underestimate the cross section by orders of magnitude (see the main text). This is due partly to the missing Sommerfeld enhancement, which was also discussed in the context of DM-induced ionizations in Ref. <xref ref-type="bibr" rid="c47">[47]</xref>. The effect arises due to the attractive potential of the nucleus, which enhances the value of the unbound electron wave function near the nucleus. As discussed above in the main text, it is only the portion of the wave function close to the nucleus that contributes to the cross section.</p><p>The size of the Sommerfeld enhancement can be estimated for hydrogenlike <inline-formula><mml:math display="inline"><mml:mi>s</mml:mi></mml:math></inline-formula>-states as (in atomic units) <disp-formula id="da11"><mml:math display="block"><mml:mrow><mml:mfrac><mml:mrow><mml:msub><mml:mrow><mml:mi>K</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:msub><mml:mrow><mml:mi>s</mml:mi></mml:mrow><mml:mrow><mml:mn>1</mml:mn><mml:mo stretchy="false">/</mml:mo><mml:mn>2</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:msub></mml:mrow><mml:mrow><mml:msubsup><mml:mrow><mml:mi>K</mml:mi></mml:mrow><mml:mrow><mml:mi>n</mml:mi><mml:msub><mml:mrow><mml:mi>s</mml:mi></mml:mrow><mml:mrow><mml:mn>1</mml:mn><mml:mo stretchy="false">/</mml:mo><mml:mn>2</mml:mn></mml:mrow></mml:msub></mml:mrow><mml:mrow><mml:mi>pw</mml:mi></mml:mrow></mml:msubsup></mml:mrow></mml:mfrac><mml:msub><mml:mrow><mml:mo>|</mml:mo></mml:mrow><mml:mrow><mml:mi>r</mml:mi><mml:mo stretchy="false">→</mml:mo><mml:mn>0</mml:mn></mml:mrow></mml:msub><mml:mo>≈</mml:mo><mml:mfrac><mml:mrow><mml:mn>8</mml:mn><mml:mi>π</mml:mi><mml:mi>Z</mml:mi></mml:mrow><mml:mrow><mml:mrow><mml:mo stretchy="false">[</mml:mo><mml:mn>1</mml:mn><mml:mo>-</mml:mo><mml:mi>exp</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mo>-</mml:mo><mml:mfrac><mml:mrow><mml:mn>2</mml:mn><mml:mi>π</mml:mi><mml:mi>Z</mml:mi></mml:mrow><mml:mrow><mml:mo stretchy="false">|</mml:mo><mml:msup><mml:mrow><mml:mi>p</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:mo stretchy="false">|</mml:mo></mml:mrow></mml:mfrac><mml:mo stretchy="false">)</mml:mo><mml:mo stretchy="false">]</mml:mo></mml:mrow><mml:msup><mml:mrow><mml:mi>n</mml:mi></mml:mrow><mml:mrow><mml:mn>3</mml:mn></mml:mrow></mml:msup><mml:mo stretchy="false">|</mml:mo><mml:msup><mml:mrow><mml:mi>p</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:mo stretchy="false">|</mml:mo></mml:mrow></mml:mfrac><mml:mo>,</mml:mo></mml:mrow></mml:math><label>(A11)</label></disp-formula>where each of the <inline-formula><mml:math display="inline"><mml:mi>K</mml:mi></mml:math></inline-formula> terms is calculated using only the leading small-<inline-formula><mml:math display="inline"><mml:mrow><mml:mi>r</mml:mi></mml:mrow></mml:math></inline-formula> terms in the expansion of the wave function and <inline-formula><mml:math display="inline"><mml:mrow><mml:msup><mml:mrow><mml:mi>p</mml:mi></mml:mrow><mml:mrow><mml:mo>′</mml:mo></mml:mrow></mml:msup><mml:mo>=</mml:mo><mml:msqrt><mml:mrow><mml:mn>2</mml:mn><mml:msub><mml:mrow><mml:mi>m</mml:mi></mml:mrow><mml:mrow><mml:mi>e</mml:mi></mml:mrow></mml:msub><mml:mi>ϵ</mml:mi></mml:mrow></mml:msqrt></mml:mrow></mml:math></inline-formula> is the momentum of the outgoing electron. In the nonrelativistic limit, the contribution to <inline-formula><mml:math display="inline"><mml:mi>K</mml:mi></mml:math></inline-formula> coming from the first-order term in the small-<inline-formula><mml:math display="inline"><mml:mrow><mml:mi>r</mml:mi></mml:mrow></mml:math></inline-formula> expansion of the electron wave functions is identically zero, and the leading nonzero contribution only arises at second order. In contrast, using relativistic functions, one finds that the lowest-order term survives, leading to significant relative enhancement due to relativistic electron effects <xref ref-type="bibr" rid="c26">[26]</xref>. Therefore, the nonrelativistic equation <xref ref-type="disp-formula" rid="da11">(A11)</xref> also underestimates the relative enhancement. Scaling of inner-shell electron wave functions near the nucleus goes as <inline-formula><mml:math display="inline"><mml:mo stretchy="false">|</mml:mo><mml:mi>ψ</mml:mi><mml:mo stretchy="false">(</mml:mo><mml:mn>0</mml:mn><mml:mo stretchy="false">)</mml:mo><mml:msup><mml:mo stretchy="false">|</mml:mo><mml:mn>2</mml:mn></mml:msup><mml:mo>∼</mml:mo><mml:msup><mml:mi>Z</mml:mi><mml:mn>3</mml:mn></mml:msup></mml:math></inline-formula>, as for hydrogenlike functions. However, the scaling for outer-shell electrons is not as simple <xref ref-type="bibr" rid="c58">[58]</xref>, so it is important to use electron wave functions that correctly reproduce the low-<inline-formula><mml:math display="inline"><mml:mrow><mml:mi>r</mml:mi></mml:mrow></mml:math></inline-formula> behavior, including the correct screening and electron relativistic effects (e.g., the relativistic Hartree-Fock method, as employed here).</p></sec></app></app-group><ref-list><ref id="c1"><label>[1]</label><mixed-citation publication-type="journal"><object-id>1</object-id><person-group person-group-type="author"><string-name>J. Liu</string-name>, <string-name>X. Chen</string-name>, and <string-name>X. Ji</string-name></person-group>, <source>Nat. 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