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<front>
<journal-meta>
<journal-id journal-id-type="publisher-id">ptep</journal-id>
<journal-title-group>
<journal-title>Progress of Theoretical and Experimental Physics</journal-title>
</journal-title-group>
<issn pub-type="epub">2050-3911</issn>
<publisher>
<publisher-name>Oxford University Press</publisher-name>
</publisher>
</journal-meta>
<article-meta>
<article-id pub-id-type="doi">10.1093/ptep/ptaa044</article-id>
<article-id pub-id-type="publisher-id">ptaa044</article-id>
<article-id pub-id-type="arxiv">arXiv:2001.11779</article-id>
<article-categories>
<subj-group subj-group-type="category-toc-heading">
<subject>Papers</subject>
<subj-group subj-group-type="category-toc-heading">
<subject>Theoretical Particle Physics</subject>
</subj-group>
</subj-group>
<subj-group subj-group-type="category-taxonomy-collection">
<subject>PTEP/B01</subject>
<subject>PTEP/B38</subject>
<subject>PTEP/B64</subject>
</subj-group>
</article-categories>
<title-group>
<article-title>Reconstruction of smeared spectral functions from Euclidean correlation functions</article-title>
</title-group>
<contrib-group>
<contrib contrib-type="author">
<name><surname>Bailas</surname> <given-names>Gabriela</given-names></name>
<xref ref-type="aff" rid="AFF1"/>
</contrib>
<contrib contrib-type="author" corresp="yes">
<name><surname>Hashimoto</surname> <given-names>Shoji</given-names></name>
<xref ref-type="aff" rid="AFF1"/>
<xref ref-type="aff" rid="AFF2"/>
<xref ref-type="corresp" rid="COR1"/>
<email xlink:type="simple">shoji.hashimoto@kek.jp</email>
</contrib>
<contrib contrib-type="author">
<name><surname>Ishikawa</surname> <given-names>Tsutomu</given-names></name>
<xref ref-type="aff" rid="AFF2"/>
</contrib>
</contrib-group>
<aff id="AFF1"><institution>Theory Center, High Energy Accelerator Research Organization (KEK)</institution>, Tsukuba 305-0801, <country country="JP">Japan</country></aff>
<aff id="AFF2"><institution>School of High Energy Accelerator Science, The Graduate University for Advanced Studies (SOKENDAI)</institution>, Tsukuba 305-0801, <country country="JP">Japan</country></aff>
<author-notes>
<corresp id="COR1">E-mail: <email>shoji.hashimoto@kek.jp</email></corresp>
</author-notes>
<pub-date pub-type="cover">
<month>04</month>
<year>2020</year>
</pub-date>
<pub-date pub-type="collection">
<day>01</day>
<month>04</month>
<year>2020</year>
</pub-date>
<pub-date pub-type="epub" iso-8601-date="2020-04-30">
<day>30</day>
<month>04</month>
<year>2020</year>
</pub-date>
<volume>2020</volume>
<issue>4</issue>
<elocation-id>043B07</elocation-id>
<history>
<date date-type="received">
<day>31</day>
<month>01</month>
<year>2020</year>
</date>
<date date-type="rev-recd">
<day>03</day>
<month>03</month>
<year>2020</year>
</date>
<date date-type="accepted">
<day>09</day>
<month>03</month>
<year>2020</year>
</date>
</history>
<permissions>
<copyright-statement>&#x00A9; The Author(s) 2020. Published by Oxford University Press on behalf of the Physical Society of Japan.</copyright-statement>
<copyright-year>2020</copyright-year>
<license license-type="cc-by" xlink:href="http://creativecommons.org/licenses/by/4.0/">
<license-p>This is an Open Access article distributed under the terms of the Creative Commons Attribution License (<ext-link ext-link-type="uri" xmlns:xlink="http://www.w3.org/1999/xlink" xlink:href="http://creativecommons.org/licenses/by/4.0/">http://creativecommons.org/licenses/by/4.0/</ext-link>), which permits unrestricted reuse, distribution, and reproduction in any medium, provided the original work is properly cited.</license-p>
<license-p>Funded by SCOAP<sup>3</sup></license-p>
</license>
</permissions>
<self-uri xlink:href="ptaa044.pdf"/>
<abstract abstract-type="abstract">
<title>Abstract</title>
<p>We propose a method to reconstruct smeared spectral functions from two-point correlation functions measured on the Euclidean lattice. An arbitrary smearing function can be considered as long as it is smooth enough to allow an approximation using Chebyshev polynomials. We test the method with numerical lattice data of charmonium correlators. The method provides a framework to compare lattice calculation with experimental data including excited-state contributions without assuming quark&#x2013;hadron duality.</p>
</abstract>
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<kwd>B38</kwd>
<kwd>B64</kwd>
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<funding-group>
<award-group award-type="grant">
<funding-source>
<institution-wrap><institution>JSPS KAKENHI</institution>
</institution-wrap></funding-source>
<award-id>18H03710</award-id>
</award-group>
<award-group award-type="grant">
<funding-source>
<institution-wrap><institution>SCOAP</institution>
</institution-wrap></funding-source>
</award-group>
</funding-group>
<counts>
<page-count count="19"/>
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</front>
<body>
<sec id="SEC1"><title>1. Introduction</title>
<p>Reconstruction of the hadron spectral function from Euclidean correlation functions is a notoriously difficult problem. In lattice quantum chromodynamics (LQCD) computations, which have so far been the only practical method to calculate non-perturbative quantities with errors under control, physical quantities are extracted from <inline-formula><tex-math notation="LaTeX" id="ImEquation1"><![CDATA[$n$]]></tex-math></inline-formula>-point correlation functions obtained on a Euclidean lattice. This means that all momenta inserted are space-like, so that physical amplitudes, especially those for on-shell particles or resonances, have to be read off from this unphysical setup. The ground-state contribution can be obtained relatively easily by measuring an exponential fall-off of the correlator at long distances, while excited states are much harder to identify because the exponential function of the form <inline-formula><tex-math notation="LaTeX" id="ImEquation2"><![CDATA[$\exp(-Et)$]]></tex-math></inline-formula> with an energy <inline-formula><tex-math notation="LaTeX" id="ImEquation3"><![CDATA[$E$]]></tex-math></inline-formula> and a time separation <inline-formula><tex-math notation="LaTeX" id="ImEquation4"><![CDATA[$t$]]></tex-math></inline-formula> is numerically very similar for different <inline-formula><tex-math notation="LaTeX" id="ImEquation5"><![CDATA[$E$]]></tex-math></inline-formula>, especially when many energy levels are close to each other as in the experimental situation. Typically, then, only one or even none of the excited states can be identified.</p>
<p>Still, because the spectral function is of phenomenological interest for various applications, several groups developed methods to extract it, adding some extra pieces of information. The maximum entropy method [<xref ref-type="bibr" rid="B1">1</xref>,<xref ref-type="bibr" rid="B2">2</xref>] is one of such attempts, where one assumes that unknown functions (or their parameters) are statistically equally distributed within the model space and tries to determine the most &#x201C;likely&#x201D; function. A slightly different statistical approach based on Bayesian statistics was also proposed [<xref ref-type="bibr" rid="B3">3</xref>]. Unfortunately, they are not free from uncertainties since the <italic>statistical distribution</italic> of the spectral function does not really have a theoretical basis. A similar problem would also remain in a recent attempt to use machine learning to reconstruct the spectral function [<xref ref-type="bibr" rid="B4">4</xref>].</p>
<p>Another attempt to approach the problem is the use of the Backus&#x2013;Gilbert method, which is a deterministic method to obtain a smeared spectral function [<xref ref-type="bibr" rid="B5">5</xref>]. The smearing kernel is automatically determined by the data, requiring that the width of the smearing is minimized. In practice, one has to relax the minimization by adding an extra term to the function to be minimized in order to avoid numerical instability. The smearing kernel is therefore unknown until one actually performs such analysis. There is also a proposal to arrange the Backus&#x2013;Gilbert method such that the smearing kernel obtained becomes close to what one inputs [<xref ref-type="bibr" rid="B6">6</xref>]. Several such methods have been tested with mock data led from a known spectral function [<xref ref-type="bibr" rid="B7">7</xref>], and there is no obvious best solution found so far. A similar test has also been performed for reconstruction of the parton distribution function from lattice data of position-space matrix elements [<xref ref-type="bibr" rid="B8">8</xref>].</p>
<p>We propose an alternative method to reconstruct the spectral function with smearing specified by arbitrary kernels. The Chebyshev polynomials are introduced to approximate the kernel function, and a smeared spectral function under this approximation is obtained from lattice data of the temporal correlator. The procedure is deterministic and the systematic error due to a truncation of the Chebyshev polynomials can be estimated. A limitation of the method comes from the statistical error of the lattice data, which prevents one from using high-order polynomials.</p>
<p>The smeared spectral function can offer an intermediate quantity that can be used to compare experimental data with the non-perturbative theoretical calculation provided by LQCD. For instance, let us consider the <inline-formula><tex-math notation="LaTeX" id="ImEquation6"><![CDATA[$R$]]></tex-math></inline-formula>-ratio <inline-formula><tex-math notation="LaTeX" id="ImEquation7"><![CDATA[$R(s)$]]></tex-math></inline-formula> defined for the <inline-formula><tex-math notation="LaTeX" id="ImEquation8"><![CDATA[$e^+e^-\to q\bar{q}$]]></tex-math></inline-formula> cross section as <inline-formula><tex-math notation="LaTeX" id="ImEquation9"><![CDATA[$R(s)=\sigma_{e^+e^-\to q\bar{q}}(s)/\sigma_{e^+e^-\to\mu^+\mu^-}(s)$]]></tex-math></inline-formula>. It cannot be directly compared with perturbative calculations in the resonance region where perturbative expansion does not converge. The LQCD calculation as it stands is not useful either, because it can only calculate the low-lying hadron spectrum and scattering phase shift for specified final states, such as <inline-formula><tex-math notation="LaTeX" id="ImEquation10"><![CDATA[$\pi^+\pi^-$]]></tex-math></inline-formula> or <inline-formula><tex-math notation="LaTeX" id="ImEquation11"><![CDATA[$K\bar{K}$]]></tex-math></inline-formula>, but a fully inclusive rate is unavailable. Our method concerns how to extract the information for inclusive processes, such as <inline-formula><tex-math notation="LaTeX" id="ImEquation12"><![CDATA[$q\bar{q}$]]></tex-math></inline-formula>, from lattice results of hadron correlators without specifying any final states. The <inline-formula><tex-math notation="LaTeX" id="ImEquation13"><![CDATA[$R$]]></tex-math></inline-formula>-ratio as a function of invariant mass of the final states is not directly accessible in our method, but the function that is smeared with some kernel can be related to quantities calculable on the lattice.</p>
<p>The smeared spectral function was considered in the early days of perturbative QCD by Poggio, Quinn, and Weinberg [<xref ref-type="bibr" rid="B9">9</xref>]. They considered a smearing of the form
<disp-formula id="ptaa044M1"><label>(1)</label><tex-math notation="LaTeX" id="Equation1"><![CDATA[$$\begin{equation}
\label{eq:smearing}
\bar{R}(s,\Delta_s)=\frac{\Delta_s}{\pi}\int_0^\infty ds'
\frac{R(s')}{(s'-s)^2+\Delta_s^2},
\end{equation}$$]]></tex-math></disp-formula>
whose kernel approaches a delta function <inline-formula><tex-math notation="LaTeX" id="ImEquation14"><![CDATA[$\delta(s-s')$]]></tex-math></inline-formula> in the limit of the width <inline-formula><tex-math notation="LaTeX" id="ImEquation15"><![CDATA[$\Delta_s\to 0$]]></tex-math></inline-formula>. The <inline-formula><tex-math notation="LaTeX" id="ImEquation16"><![CDATA[$R$]]></tex-math></inline-formula>-ratio (or the spectral function) can be related to the vacuum polarization function through the optical theorem <inline-formula><tex-math notation="LaTeX" id="ImEquation17"><![CDATA[$R(s)=(1/\pi){\rm Im}\Pi(s)$]]></tex-math></inline-formula> and the dispersion relation<sup><xref ref-type="fn" rid="FN1">1</xref></sup>
<disp-formula id="ptaa044M2"><label>(2)</label><tex-math notation="LaTeX" id="Equation2"><![CDATA[$$\begin{equation}
\label{eq:dispersion}
\Pi(q^2)=\frac{1}{\pi}\int_0^\infty ds \frac{{\rm Im}\Pi(s)}{s-q^2}.
\end{equation}$$]]></tex-math></disp-formula></p>
<p>The smeared spectrum can then be written using the vacuum polarization function at complex values of <inline-formula><tex-math notation="LaTeX" id="ImEquation18"><![CDATA[$q^2$]]></tex-math></inline-formula>:
<disp-formula id="ptaa044M3"><label>(3)</label><tex-math notation="LaTeX" id="Equation3"><![CDATA[$$\begin{equation}
2i\bar{R}(s,\Delta_s)=\Pi(s+i\Delta_s)-\Pi(s-i\Delta_s).
\end{equation}$$]]></tex-math></disp-formula></p>
<p>The main observation was that, unlike the imaginary part <inline-formula><tex-math notation="LaTeX" id="ImEquation19"><![CDATA[${\rm Im}\Pi(s)$]]></tex-math></inline-formula> evaluated on the cut, one can avoid the non-perturbative kinematical region and calculate <inline-formula><tex-math notation="LaTeX" id="ImEquation20"><![CDATA[$\Pi(s+i\Delta_s)$]]></tex-math></inline-formula> in perturbation theory as long as the smearing range <inline-formula><tex-math notation="LaTeX" id="ImEquation21"><![CDATA[$\Delta_s$]]></tex-math></inline-formula> is large enough. This is the argument behind the quark&#x2013;hadron duality. The width parameter <inline-formula><tex-math notation="LaTeX" id="ImEquation22"><![CDATA[$\Delta_s$]]></tex-math></inline-formula> is typically chosen larger than the QCD scale <inline-formula><tex-math notation="LaTeX" id="ImEquation23"><![CDATA[$\Lambda_{\rm QCD}$]]></tex-math></inline-formula>, but there is no <italic>a priori</italic> criteria of how large <inline-formula><tex-math notation="LaTeX" id="ImEquation24"><![CDATA[$\Delta_s$]]></tex-math></inline-formula> should be for perturbation theory to work to a desired accuracy. One can also consider a Gaussian smearing instead of Eq. (<xref ref-type="disp-formula" rid="ptaa044M15">15</xref>), and arrive at the same conclusion [<xref ref-type="bibr" rid="B10">10</xref>].</p>
<p>In many applications of perturbative QCD, such as deep inelastic scattering or inclusive hadron decays, the smearing is not as transparent as in this example. Some smearing over kinematical variables is involved depending on the setup of the problems, and the question of how much smearing is introduced is more obscure. Yet, one usually assumes that perturbation theory works; systematic error due to this duality assumption is unknown.</p>
<p>Another commonly used form of smearing is the Laplace transform
<disp-formula id="ptaa044M4"><label>(4)</label><tex-math notation="LaTeX" id="Equation4"><![CDATA[$$\begin{equation}
\label{eq:Laplace}
\tilde{\Pi}(M^2)=\frac{1}{M^2}\int_0^\infty\! ds\,
\left[\frac{1}{\pi} {\rm Im}\Pi(s)\right]
e^{-s/M^2},
\end{equation}$$]]></tex-math></disp-formula>
which is related to the Borel transform involved in QCD sum rule calculations [<xref ref-type="bibr" rid="B11">11</xref>]. Since <inline-formula><tex-math notation="LaTeX" id="ImEquation25"><![CDATA[$\tilde{\Pi}(M^2)$]]></tex-math></inline-formula> can be written using the vacuum polarization function <inline-formula><tex-math notation="LaTeX" id="ImEquation26"><![CDATA[$\Pi(Q^2)$]]></tex-math></inline-formula> in the space-like domain, the non-perturbative kinematical region is avoided. The effective range of smearing is controlled by the parameter <inline-formula><tex-math notation="LaTeX" id="ImEquation27"><![CDATA[$M^2$]]></tex-math></inline-formula>.</p>
<p>Of course, one can view the dispersion relation (<xref ref-type="disp-formula" rid="ptaa044M2">2</xref>) for a space-like value of <inline-formula><tex-math notation="LaTeX" id="ImEquation28"><![CDATA[$q^2=-Q^2$]]></tex-math></inline-formula>:
<disp-formula id="ptaa044M5"><label>(5)</label><tex-math notation="LaTeX" id="Equation5"><![CDATA[$$\begin{equation}
\Pi(Q^2)=\frac{1}{\pi}\int_0^\infty ds\,\frac{{\rm Im}\Pi(s)}{s+Q^2},
\end{equation}$$]]></tex-math></disp-formula>
or its subtracted version
<disp-formula id="ptaa044M6"><label>(6)</label><tex-math notation="LaTeX" id="Equation6"><![CDATA[$$\begin{equation}
\Pi(Q^2)-\Pi(0)=
-\frac{Q^2}{\pi}\int_0^\infty ds\,\frac{{\rm Im}\Pi(s)}{s(s+Q^2)},
\end{equation}$$]]></tex-math></disp-formula>
as a sort of smearing. The range of smearing is effectively infinity as the weight function decreases only by a power of <inline-formula><tex-math notation="LaTeX" id="ImEquation29"><![CDATA[$s$]]></tex-math></inline-formula>. This is another way of keeping away from the resonance region, and perturbation theory is expected to be applicable. One still needs to include power corrections using the operator product expansion, which involves unknown parameters (or condensates); LQCD calculation is desirable to eliminate such uncertainties.</p>
<p>We develop a formalism of LQCD calculation that allows us to compute the quantities mentioned above, i.e., those obtained by applying some smearing on the spectral function. The smearings are designed to escape from the resonance region to some extent, so that perturbation theory is applicable, but some uncertainty still remains as mentioned above. By using LQCD, on the other hand, a fully non-perturbative calculation can be achieved and no remnant uncertainty due to the singularities nor the power corrections remains. In other words, one can entirely avoid the assumption of quark&#x2013;hadron duality.</p>
<p>Through this method, the comparison between experimental data and lattice calculation would provide a theoretically clean test of QCD. It can also provide a testing ground for a perturbative QCD analysis including operator product expansion against the fully non-perturbative lattice calculation.</p>
<p>This paper is organized as follows. In Sect. <xref ref-type="sec" rid="SEC2">2</xref> we introduce the method to reconstruct the smeared spectral function. It includes an approximation using the Chebyshev polynomials, whose performance is demonstrated for several cases with toy examples in Sect. <xref ref-type="sec" rid="SEC3">3</xref>. Then, the method is tested with actual lattice data for the charmonium correlator in Sect. <xref ref-type="sec" rid="SEC4">4</xref>. The discussion section (Sect. <xref ref-type="sec" rid="SEC5">5</xref>) lists possible applications of the methods including phenomenological ones as well as those of theoretical interests related to the QCD sum rule. Our conclusions are given in Sect. <xref ref-type="sec" rid="SEC6">6</xref>.</p>
</sec>
<sec id="SEC2"><title>2. Reconstruction of the smeared spectral function</title>
<p>We are interested in the spectral density of a state <inline-formula><tex-math notation="LaTeX" id="ImEquation30"><![CDATA[$|\psi\rangle$]]></tex-math></inline-formula> defined as
<disp-formula id="ptaa044M7"><label>(7)</label><tex-math notation="LaTeX" id="Equation7"><![CDATA[$$\begin{equation}
\label{eq:spectral_func}
\bar\rho(\omega)=\frac{\langle\psi|\delta(\hat{H}-\omega)
|\psi\rangle}{\langle\psi|\psi\rangle}.
\end{equation}$$]]></tex-math></disp-formula></p>
<p>The spectral function <inline-formula><tex-math notation="LaTeX" id="ImEquation31"><![CDATA[$\bar\rho(\omega)$]]></tex-math></inline-formula> is defined such that it counts the number of states for a given energy <inline-formula><tex-math notation="LaTeX" id="ImEquation32"><![CDATA[$\omega$]]></tex-math></inline-formula>, which is assumed to be positive, and is normalized to become unity when integrated over all possible energy <inline-formula><tex-math notation="LaTeX" id="ImEquation33"><![CDATA[$\omega$]]></tex-math></inline-formula>. The state <inline-formula><tex-math notation="LaTeX" id="ImEquation34"><![CDATA[$|\psi\rangle$]]></tex-math></inline-formula> does not have to be an eigenstate of the Hamiltonian <inline-formula><tex-math notation="LaTeX" id="ImEquation35"><![CDATA[$\hat{H}$]]></tex-math></inline-formula>, but can be created by applying some operator on the vacuum, e.g., <inline-formula><tex-math notation="LaTeX" id="ImEquation36"><![CDATA[$\sum_xJ_\mu(x)|0\rangle$]]></tex-math></inline-formula> for the case of <inline-formula><tex-math notation="LaTeX" id="ImEquation37"><![CDATA[$e^+e^-\to q\bar{q}$]]></tex-math></inline-formula>. Here <inline-formula><tex-math notation="LaTeX" id="ImEquation38"><![CDATA[$J_\mu(x)$]]></tex-math></inline-formula> is the electromagnetic current and the sum over <inline-formula><tex-math notation="LaTeX" id="ImEquation39"><![CDATA[$x$]]></tex-math></inline-formula> gives the (spatial) zero-momentum projection. An extension to the case of different initial and final states should be possible.</p>
<p>In the K&#x00E4;llen&#x2013;Lehmann representation, the spectral function <inline-formula><tex-math notation="LaTeX" id="ImEquation40"><![CDATA[$\rho(p^2)$]]></tex-math></inline-formula> is usually defined through
<disp-formula id="ptaa044M8"><label>(8)</label><tex-math notation="LaTeX" id="Equation8"><![CDATA[$$\begin{equation}
\label{eq:Kallen-Lehmann}
\sum_n (2\pi)^3\delta^{(4)}(p-p_n)
|\langle n|\Phi^\dagger(0)|0\rangle|^2
=
\theta(p^0)\rho(p^2)
\end{equation}$$]]></tex-math></disp-formula>
for some operator <inline-formula><tex-math notation="LaTeX" id="ImEquation41"><![CDATA[$\Phi^\dagger(0)$]]></tex-math></inline-formula> to create a set of states <inline-formula><tex-math notation="LaTeX" id="ImEquation42"><![CDATA[$|n\rangle$]]></tex-math></inline-formula> from the vacuum <inline-formula><tex-math notation="LaTeX" id="ImEquation43"><![CDATA[$|0\rangle$]]></tex-math></inline-formula>. Our definition of <inline-formula><tex-math notation="LaTeX" id="ImEquation44"><![CDATA[$\bar{\rho}(\omega)$]]></tex-math></inline-formula> is equivalent to this definition of <inline-formula><tex-math notation="LaTeX" id="ImEquation45"><![CDATA[$\rho(p^2)$]]></tex-math></inline-formula> up to a normalization factor.<sup><xref ref-type="fn" rid="FN2">2</xref></sup> In fact, we may identify <inline-formula><tex-math notation="LaTeX" id="ImEquation46"><![CDATA[$\Phi^\dagger|0\rangle$]]></tex-math></inline-formula> by <inline-formula><tex-math notation="LaTeX" id="ImEquation47"><![CDATA[$|\psi\rangle=\sum_xJ_\mu(x)|0\rangle$]]></tex-math></inline-formula> when the spatial component of the four-momentum <inline-formula><tex-math notation="LaTeX" id="ImEquation48"><![CDATA[$p$]]></tex-math></inline-formula> is zero. Then, by inserting a complete set of states <inline-formula><tex-math notation="LaTeX" id="ImEquation49"><![CDATA[$\sum_n|n\rangle\langle n|$]]></tex-math></inline-formula> in Eq. (<xref ref-type="disp-formula" rid="ptaa044M7">7</xref>), one ends up with Eq. (<xref ref-type="disp-formula" rid="ptaa044M8">8</xref>) after identifying <inline-formula><tex-math notation="LaTeX" id="ImEquation50"><![CDATA[$\rho(p^2)$]]></tex-math></inline-formula> by <inline-formula><tex-math notation="LaTeX" id="ImEquation51"><![CDATA[$\bar{\rho}(\omega)$]]></tex-math></inline-formula> and up to a normalization factor. When going back to the Minkowski space by a Wick rotation from <inline-formula><tex-math notation="LaTeX" id="ImEquation52"><![CDATA[$i\omega$]]></tex-math></inline-formula> to <inline-formula><tex-math notation="LaTeX" id="ImEquation53"><![CDATA[$p^0$]]></tex-math></inline-formula>, the negative energy state (or the states propagating back in time) has to be considered too. (If the operator <inline-formula><tex-math notation="LaTeX" id="ImEquation54"><![CDATA[$\Phi$]]></tex-math></inline-formula> is CP invariant, the same states propagate in the negative time direction. Otherwise, the states involved may be different.) An extra sign has to be attached for the propagator of the negative energy states in order to respect the Lorentz invariance. So, a convention <inline-formula><tex-math notation="LaTeX" id="ImEquation55"><![CDATA[$\rho(\omega)=-\zeta\rho(-\omega)$]]></tex-math></inline-formula> is found for bosonic (<inline-formula><tex-math notation="LaTeX" id="ImEquation56"><![CDATA[$\zeta=+1$]]></tex-math></inline-formula>) and fermionic (<inline-formula><tex-math notation="LaTeX" id="ImEquation57"><![CDATA[$\zeta=-1$]]></tex-math></inline-formula>) states (e.g., see Ref. [<xref ref-type="bibr" rid="B12">12</xref>]).</p>
<p>On the lattice, we calculate the temporal correlation function
<disp-formula id="ptaa044M9"><label>(9)</label><tex-math notation="LaTeX" id="Equation9"><![CDATA[$$\begin{equation}
\label{eq:correlator}
\bar{C}(t) = \frac{\langle\psi|e^{-\hat{H}t}|\psi\rangle}{
\langle\psi|\psi\rangle},
\end{equation}$$]]></tex-math></disp-formula>
which is normalized to one at zero time separation. It can be rewritten using the spectral function as
<disp-formula id="ptaa044M10"><label>(10)</label><tex-math notation="LaTeX" id="Equation10"><![CDATA[$$\begin{equation}
\label{eq:rhobar}
\bar{C}(t) =
\frac{\langle\psi| \int_0^\infty\! d\omega\,
\delta(\hat{H}-\omega) e^{-\omega t} |\psi\rangle}{
\langle\psi|\psi\rangle} =
\int_0^\infty\! d\omega\,\bar\rho(\omega)e^{-\omega t},
\end{equation}$$]]></tex-math></disp-formula>
thus the conventional spectral decomposition of a correlator.</p>
<p>In practice, we can take the state <inline-formula><tex-math notation="LaTeX" id="ImEquation58"><![CDATA[$|\psi\rangle$]]></tex-math></inline-formula> as
<disp-formula id="ptaa044M11"><label>(11)</label><tex-math notation="LaTeX" id="Equation11"><![CDATA[$$\begin{equation}
\label{eq:psi}
|\psi\rangle = e^{-\hat{H}t_0} \sum_x V_\mu|0\rangle
\end{equation}$$]]></tex-math></disp-formula>
with some (small, but non-zero) time separation <inline-formula><tex-math notation="LaTeX" id="ImEquation59"><![CDATA[$t_0$]]></tex-math></inline-formula> in order to avoid any potential divergence due to a contact term when evaluating <inline-formula><tex-math notation="LaTeX" id="ImEquation60"><![CDATA[$\langle\psi|\psi\rangle$]]></tex-math></inline-formula>. For instance, by taking <inline-formula><tex-math notation="LaTeX" id="ImEquation61"><![CDATA[$t_0=1$]]></tex-math></inline-formula> in the lattice unit, we can identify Eq. (<xref ref-type="disp-formula" rid="ptaa044M9">9</xref>) as <inline-formula><tex-math notation="LaTeX" id="ImEquation62"><![CDATA[$C(t+2)/C(2)$]]></tex-math></inline-formula> for a vector correlator <inline-formula><tex-math notation="LaTeX" id="ImEquation63"><![CDATA[$C(t)=\langle 0|V_\mu(t)V_\mu(0)|0\rangle$]]></tex-math></inline-formula>, where <inline-formula><tex-math notation="LaTeX" id="ImEquation64"><![CDATA[$\mu$]]></tex-math></inline-formula> stands for a spatial direction and is not summed over.</p>
<p>We note that the Hamiltonian <inline-formula><tex-math notation="LaTeX" id="ImEquation65"><![CDATA[$\hat{H}$]]></tex-math></inline-formula> in Eq. (<xref ref-type="disp-formula" rid="ptaa044M9">9</xref>) is not explicitly written in lattice QCD simulations, but we assume that it exists so that the time evolution is written by a transfer matrix <inline-formula><tex-math notation="LaTeX" id="ImEquation66"><![CDATA[$\hat{z}=e^{-\hat{H}}$]]></tex-math></inline-formula>. (Here, and in the following, we assume the lattice unit and write <inline-formula><tex-math notation="LaTeX" id="ImEquation67"><![CDATA[$e^{-\hat{H}}$]]></tex-math></inline-formula> instead of <inline-formula><tex-math notation="LaTeX" id="ImEquation68"><![CDATA[$e^{-a\hat{H}}$]]></tex-math></inline-formula>, for instance.) We also assume that the eigenvalues of <inline-formula><tex-math notation="LaTeX" id="ImEquation69"><![CDATA[$\hat{H}$]]></tex-math></inline-formula> are non-negative and equivalently that the eigenvalues of <inline-formula><tex-math notation="LaTeX" id="ImEquation70"><![CDATA[$\hat{z}$]]></tex-math></inline-formula> are constrained to lie between 0 and 1. Strictly speaking, many lattice actions currently used in numerical simulations do not satisfy the <italic>reflection positivity</italic>, which is a necessary condition for a Hermitian Hamiltonian to exist. Any problem due to the violation of the reflection positivity is expected to disappear in the continuum limit. Our assumption is, therefore, that our lattice calculations are sufficiently close to the continuum limit. Using the transfer matrix <inline-formula><tex-math notation="LaTeX" id="ImEquation71"><![CDATA[$\hat{z}$]]></tex-math></inline-formula>, the correlator in Eq. (<xref ref-type="disp-formula" rid="ptaa044M9">9</xref>) is simply written as <inline-formula><tex-math notation="LaTeX" id="ImEquation72"><![CDATA[$\bar{C}(t)=\langle\psi|\hat{z}^t|\psi\rangle/\langle\psi|\psi\rangle$]]></tex-math></inline-formula>.</p>
<p>For the vacuum polarization function due to electromagnetic currents,
<disp-formula id="ptaa044M12"><label>(12)</label><tex-math notation="LaTeX" id="Equation12"><![CDATA[$$\begin{equation}
\Pi_{\mu\nu}(q)=(q_\mu q_\nu-q^2\delta_{\mu\nu})\Pi(q^2)
= \int\!d^4x\,e^{iq\cdot x}\langle 0|J_\mu(x)J_\nu(0)|0\rangle,
\end{equation}$$]]></tex-math></disp-formula>
the spectral function is often defined as <inline-formula><tex-math notation="LaTeX" id="ImEquation73"><![CDATA[$\rho(s)=(1/\pi){\rm Im}\Pi(s)$]]></tex-math></inline-formula>. The Euclidean correlator is then expressed as
<disp-formula id="ptaa044M13"><label>(13)</label><tex-math notation="LaTeX" id="Equation13"><![CDATA[$$\begin{equation}
C(t)=\int_0^\infty d\omega\,\omega^2\rho(\omega^2) e^{-\omega t}
\end{equation}$$]]></tex-math></disp-formula>
(see Ref. [<xref ref-type="bibr" rid="B13">13</xref>], for instance). This is slightly different from Eq. (<xref ref-type="disp-formula" rid="ptaa044M9">9</xref>), but can be related by redefining the spectral function.<sup><xref ref-type="fn" rid="FN3">3</xref></sup> Namely, we define <inline-formula><tex-math notation="LaTeX" id="ImEquation74"><![CDATA[$\bar{C}(t)$]]></tex-math></inline-formula> as <inline-formula><tex-math notation="LaTeX" id="ImEquation75"><![CDATA[$\bar{C}(t)\equiv C(t+2t_0)/C(2t_0)$]]></tex-math></inline-formula>, so that the spectral function <inline-formula><tex-math notation="LaTeX" id="ImEquation76"><![CDATA[$\bar{\rho}(\omega)$]]></tex-math></inline-formula> in Eq. (<xref ref-type="disp-formula" rid="ptaa044M10">10</xref>) is <inline-formula><tex-math notation="LaTeX" id="ImEquation77"><![CDATA[$\bar{\rho}(\omega)=(1/C(2t_0))\omega^2\rho(\omega^2)e^{-2\omega t_0}$]]></tex-math></inline-formula>. We note that the normalization factor <inline-formula><tex-math notation="LaTeX" id="ImEquation78"><![CDATA[$C(2t_0)$]]></tex-math></inline-formula> is explicitly calculable on the lattice.</p>
<p>Now we define a smeared spectral function <inline-formula><tex-math notation="LaTeX" id="ImEquation79"><![CDATA[$\bar\rho_\Delta(\omega)$]]></tex-math></inline-formula> for a smearing kernel <inline-formula><tex-math notation="LaTeX" id="ImEquation80"><![CDATA[$S_\Delta(\omega,\omega')$]]></tex-math></inline-formula> as
<disp-formula id="ptaa044M14"><label>(14)</label><tex-math notation="LaTeX" id="Equation14"><![CDATA[$$\begin{eqnarray}
\label{eq:rhoDelta}
\bar\rho_\Delta(\omega) &=& \int_0^\infty d\omega' S_\Delta(\omega,\omega')
\bar\rho(\omega')
\nonumber\\
&=&
\frac{\langle\psi| \int_0^\infty d\omega'
S_\Delta(\omega,\omega')
\delta(\hat{H}-\omega') |\psi\rangle}{\langle\psi|\psi\rangle}
\nonumber\\
&=& \frac{\langle\psi| S_\Delta(\omega,\hat{H})|\psi\rangle}{
\langle\psi|\psi\rangle}.
\end{eqnarray}$$]]></tex-math></disp-formula></p>
<p>Then, the matrix element to be evaluated is <inline-formula><tex-math notation="LaTeX" id="ImEquation81"><![CDATA[$\langle\psi|S_\Delta(\omega,\hat{H})|\psi\rangle$]]></tex-math></inline-formula>. The form of the smearing kernel <inline-formula><tex-math notation="LaTeX" id="ImEquation82"><![CDATA[$S_\Delta(\omega,\omega')$]]></tex-math></inline-formula> is arbitrary; we can consider the choices discussed in the previous section. In the following, to be explicit, let us assume a specific form for <inline-formula><tex-math notation="LaTeX" id="ImEquation83"><![CDATA[$S_\Delta(\omega,\omega')$]]></tex-math></inline-formula> as
<disp-formula id="ptaa044M15"><label>(15)</label><tex-math notation="LaTeX" id="Equation15"><![CDATA[$$\begin{equation}
S_\Delta(\omega,\omega')=\frac{1}{\pi}
\frac{2\Delta}{(\omega-\omega')^2+\Delta^2},
\end{equation}$$]]></tex-math></disp-formula>
where <inline-formula><tex-math notation="LaTeX" id="ImEquation84"><![CDATA[$\Delta$]]></tex-math></inline-formula> represents a range of smearing.</p>
<p>We consider a polynomial approximation of <inline-formula><tex-math notation="LaTeX" id="ImEquation85"><![CDATA[$S_\Delta(\omega,\hat{H})$]]></tex-math></inline-formula> of the form
<disp-formula id="ptaa044M16"><label>(16)</label><tex-math notation="LaTeX" id="Equation16"><![CDATA[$$\begin{equation}
S_\Delta(\omega,\hat{H}) \simeq \frac{c_0(\omega)}{2} +
\sum_{j=1}^N c_j(\omega) T_j(\hat{z})
\label{eq:cheb_approx}
\end{equation}$$]]></tex-math></disp-formula>
with <inline-formula><tex-math notation="LaTeX" id="ImEquation86"><![CDATA[$\hat{z}=e^{-\hat{H}}$]]></tex-math></inline-formula>. Here, <inline-formula><tex-math notation="LaTeX" id="ImEquation87"><![CDATA[$T_j(x)$]]></tex-math></inline-formula> stands for the Chebyshev polynomial and the sum is up to its maximal order <inline-formula><tex-math notation="LaTeX" id="ImEquation88"><![CDATA[$N$]]></tex-math></inline-formula>. The first few terms of the Chebyshev polynomials are <inline-formula><tex-math notation="LaTeX" id="ImEquation89"><![CDATA[$T_0(x)=1$]]></tex-math></inline-formula>, <inline-formula><tex-math notation="LaTeX" id="ImEquation90"><![CDATA[$T_1(x)=x$]]></tex-math></inline-formula>, <inline-formula><tex-math notation="LaTeX" id="ImEquation91"><![CDATA[$T_2(x)=2x^2-1$]]></tex-math></inline-formula>, <inline-formula><tex-math notation="LaTeX" id="ImEquation92"><![CDATA[$T_3(x)=4x^3-3x, \ldots$]]></tex-math></inline-formula>, and one can use the recursion relation <inline-formula><tex-math notation="LaTeX" id="ImEquation93"><![CDATA[$T_{j+1}(x)=2xT_j(x)-T_{j-1}(x)$]]></tex-math></inline-formula> to construct the following ones. According to the general formula of the Chebyshev approximation, the coefficients <inline-formula><tex-math notation="LaTeX" id="ImEquation94"><![CDATA[$c_j(\omega)$]]></tex-math></inline-formula> in Eq. (<xref ref-type="disp-formula" rid="ptaa044M16">16</xref>) can be obtained as
<disp-formula id="ptaa044M17"><label>(17)</label><tex-math notation="LaTeX" id="Equation17"><![CDATA[$$\begin{equation}
c_j(\omega)=\frac{2}{\pi}\int_{-1}^1 \frac{dx}{\sqrt{1-x^2}} f_\omega(x) T_j(x),
\label{eq:cheb_coeff}
\end{equation}$$]]></tex-math></disp-formula>
where the function <inline-formula><tex-math notation="LaTeX" id="ImEquation95"><![CDATA[$f_\omega(x)$]]></tex-math></inline-formula> is written as
<disp-formula id="ptaa044M18"><label>(18)</label><tex-math notation="LaTeX" id="Equation18"><![CDATA[$$\begin{equation}
f_\omega(x) = \left\{
\begin{array}{ll}
\displaystyle
\frac{1}{\pi}\frac{2\Delta}{(\omega + \ln x)^2+\Delta^2} & (0<x\le 1),
\\
0 & (-1\le x\le 0).
\end{array}
\right.
\end{equation}$$]]></tex-math></disp-formula></p>
<p>Here, <inline-formula><tex-math notation="LaTeX" id="ImEquation96"><![CDATA[$x$]]></tex-math></inline-formula> corresponds to eigenvalues of <inline-formula><tex-math notation="LaTeX" id="ImEquation97"><![CDATA[$\hat{z}=e^{-\hat{H}}$]]></tex-math></inline-formula>, so that the function <inline-formula><tex-math notation="LaTeX" id="ImEquation98"><![CDATA[$f_\omega(x)$]]></tex-math></inline-formula> represents the smearing function (<xref ref-type="disp-formula" rid="ptaa044M15">15</xref>) with <inline-formula><tex-math notation="LaTeX" id="ImEquation99"><![CDATA[$\omega'$]]></tex-math></inline-formula> replaced by <inline-formula><tex-math notation="LaTeX" id="ImEquation100"><![CDATA[$\hat{H}$]]></tex-math></inline-formula>. This standard formula for the Chebyshev approximation is written for a function <inline-formula><tex-math notation="LaTeX" id="ImEquation101"><![CDATA[$f_\omega(x)$]]></tex-math></inline-formula> defined in <inline-formula><tex-math notation="LaTeX" id="ImEquation102"><![CDATA[$[-1,1]$]]></tex-math></inline-formula>. Here we use it only between <inline-formula><tex-math notation="LaTeX" id="ImEquation103"><![CDATA[$[0,1]$]]></tex-math></inline-formula> and assume that <inline-formula><tex-math notation="LaTeX" id="ImEquation104"><![CDATA[$f_\omega(x)$]]></tex-math></inline-formula> vanishes for <inline-formula><tex-math notation="LaTeX" id="ImEquation105"><![CDATA[$x\le 0$]]></tex-math></inline-formula>. Technically, the numerical integral (<xref ref-type="disp-formula" rid="ptaa044M17">17</xref>) becomes unstable for large <inline-formula><tex-math notation="LaTeX" id="ImEquation106"><![CDATA[$j$]]></tex-math></inline-formula> due to a divergence of the integrand as <inline-formula><tex-math notation="LaTeX" id="ImEquation107"><![CDATA[$x\to 1$]]></tex-math></inline-formula>. Instead, one may use an alternative formula,
<disp-formula id="ptaa044M19"><label>(19)</label><tex-math notation="LaTeX" id="Equation19"><![CDATA[$$\begin{equation}
c_j(\omega)=\frac{2}{\pi}\int_0^\pi d\theta\,
f_\omega(\cos\theta) \cos(j\theta),
\end{equation}$$]]></tex-math></disp-formula>
evaluation of which is more stable for large <inline-formula><tex-math notation="LaTeX" id="ImEquation108"><![CDATA[$j$]]></tex-math></inline-formula>. For the range of <inline-formula><tex-math notation="LaTeX" id="ImEquation109"><![CDATA[$x$]]></tex-math></inline-formula> between <inline-formula><tex-math notation="LaTeX" id="ImEquation110"><![CDATA[$[0,1]$]]></tex-math></inline-formula>, this integral is up to <inline-formula><tex-math notation="LaTeX" id="ImEquation111"><![CDATA[$\pi/2$]]></tex-math></inline-formula>.</p>
<p>To optimize the Chebyshev approximation, one can use a modified form written in terms of the shifted Chebyshev polynomials <inline-formula><tex-math notation="LaTeX" id="ImEquation112"><![CDATA[$T^*_n(x)\equiv T_n(2x-1)$]]></tex-math></inline-formula>, which is defined in <inline-formula><tex-math notation="LaTeX" id="ImEquation113"><![CDATA[$0\le x\le 1$]]></tex-math></inline-formula>. Its first few terms are <inline-formula><tex-math notation="LaTeX" id="ImEquation114"><![CDATA[$T_0^*(x)=1$]]></tex-math></inline-formula>, <inline-formula><tex-math notation="LaTeX" id="ImEquation115"><![CDATA[$T_1^*(x)=2x-1$]]></tex-math></inline-formula>, <inline-formula><tex-math notation="LaTeX" id="ImEquation116"><![CDATA[$T_2^*(x)=8x^2-8x+1$]]></tex-math></inline-formula>, <inline-formula><tex-math notation="LaTeX" id="ImEquation117"><![CDATA[$T_3^*(x)=32x^3-48x^2+18x-1, \ldots$]]></tex-math></inline-formula>. The corresponding formula for the coefficients appearing in the Chebyshev approximation is
<disp-formula id="ptaa044M20"><label>(20)</label><tex-math notation="LaTeX" id="Equation20"><![CDATA[$$\begin{equation}
c_j^*(\omega)=\frac{2}{\pi}\int_0^\pi d\theta\,
f_\omega\left(\frac{1+\cos\theta}{2}\right) \cos(j\theta).
\end{equation}$$]]></tex-math></disp-formula></p>
<p>The approximation formula (<xref ref-type="disp-formula" rid="ptaa044M16">16</xref>) is unchanged other than replacing <inline-formula><tex-math notation="LaTeX" id="ImEquation118"><![CDATA[$c_j(\omega)T_j(\hat{z})$]]></tex-math></inline-formula> by <inline-formula><tex-math notation="LaTeX" id="ImEquation119"><![CDATA[$c_j^*(\omega)T_j^*(\hat{z})$]]></tex-math></inline-formula>. Since the range of <inline-formula><tex-math notation="LaTeX" id="ImEquation120"><![CDATA[$x$]]></tex-math></inline-formula> is narrower, this series gives a better approximation of the original function for a given order <inline-formula><tex-math notation="LaTeX" id="ImEquation121"><![CDATA[$N$]]></tex-math></inline-formula>.</p>
<p>Finally, remember that the matrix elements of the transfer matrix <inline-formula><tex-math notation="LaTeX" id="ImEquation122"><![CDATA[$\hat{z}$]]></tex-math></inline-formula> and its power <inline-formula><tex-math notation="LaTeX" id="ImEquation123"><![CDATA[$\hat{z}^t$]]></tex-math></inline-formula> can be written as <inline-formula><tex-math notation="LaTeX" id="ImEquation124"><![CDATA[$\bar{C}(t)= \langle\psi|\hat{z}^t|\psi\rangle/\langle\psi|\psi\rangle$]]></tex-math></inline-formula>. Then, from the definition of <inline-formula><tex-math notation="LaTeX" id="ImEquation125"><![CDATA[$\bar{\rho}_\Delta(\omega)$]]></tex-math></inline-formula>, Eq. (<xref ref-type="disp-formula" rid="ptaa044M14">14</xref>), one can use the polynomial expansion of <inline-formula><tex-math notation="LaTeX" id="ImEquation126"><![CDATA[$S_\Delta(\omega,\hat{H})$]]></tex-math></inline-formula>, Eq. (<xref ref-type="disp-formula" rid="ptaa044M16">16</xref>), to obtain
<disp-formula id="ptaa044M21"><label>(21)</label><tex-math notation="LaTeX" id="Equation21"><![CDATA[$$\begin{equation}
\label{eq:rhoDelta_approx}
\bar\rho_\Delta(\omega) \simeq \frac{c_0^*(\omega)}{2}
+\sum_{j=1}^N c_j^*(\omega)\langle T_j^*(\hat{z})\rangle,
\end{equation}$$]]></tex-math></disp-formula>
where the last term <inline-formula><tex-math notation="LaTeX" id="ImEquation127"><![CDATA[$\langle T_j^*(\hat{z})\rangle$]]></tex-math></inline-formula> may be constructed from the correlator <inline-formula><tex-math notation="LaTeX" id="ImEquation128"><![CDATA[$\bar{C}(t)$]]></tex-math></inline-formula> by replacing the power of the transfer matrix <inline-formula><tex-math notation="LaTeX" id="ImEquation129"><![CDATA[$\hat{z}^t$]]></tex-math></inline-formula> appearing in <inline-formula><tex-math notation="LaTeX" id="ImEquation130"><![CDATA[$T_j^*(\hat{z})$]]></tex-math></inline-formula> by <inline-formula><tex-math notation="LaTeX" id="ImEquation131"><![CDATA[$\bar{C}(t)=\langle\psi|e^{-\hat{H}t}|\psi\rangle/\langle\psi|\psi\rangle =C(t+2t_0)/C(2t_0)$]]></tex-math></inline-formula> when <inline-formula><tex-math notation="LaTeX" id="ImEquation132"><![CDATA[$|\psi\rangle$]]></tex-math></inline-formula> is given by Eq. (<xref ref-type="disp-formula" rid="ptaa044M11">11</xref>). The first few terms are obtained as
<disp-formula id="ptaa044M22"><label>(22)</label><tex-math notation="LaTeX" id="Equation22"><![CDATA[$$
\begin{eqnarray}
\label{eq:construct_Tj}
\langle T_0^*(\hat{z})\rangle & = & 1,\nonumber\\
\langle T_1^*(\hat{z})\rangle & = & 2\bar{C}(1)-1,\nonumber\\
\langle T_2^*(\hat{z})\rangle & = & 8\bar{C}(2)-8\bar{C}(1)+1,\nonumber\\
\langle T_3^*(\hat{z})\rangle & = & 32\bar{C}(3)-48\bar{C}(2)+18\bar{C}(1)-1,
\\ & \vdots & \nonumber
\end{eqnarray}$$]]></tex-math></disp-formula>
using the definition of the shifted Chebyshev polynomials.</p>
<p>The general expression (<xref ref-type="disp-formula" rid="ptaa044M21">21</xref>) for an approximation of <inline-formula><tex-math notation="LaTeX" id="ImEquation133"><![CDATA[$\bar\rho_\Delta(\omega)$]]></tex-math></inline-formula> is valid for any smearing kernel and for any value of <inline-formula><tex-math notation="LaTeX" id="ImEquation134"><![CDATA[$\omega$]]></tex-math></inline-formula>, as long as the coefficients <inline-formula><tex-math notation="LaTeX" id="ImEquation135"><![CDATA[$c_j^*(\omega)$]]></tex-math></inline-formula> are calculated appropriately. As is well known, the Chebyshev approximation provides the <italic>best</italic> approximation of any function defined in <inline-formula><tex-math notation="LaTeX" id="ImEquation136"><![CDATA[$0\le x\le 1$]]></tex-math></inline-formula>. It is the best among any polynomials at a given order <inline-formula><tex-math notation="LaTeX" id="ImEquation137"><![CDATA[$N$]]></tex-math></inline-formula> in the sense that the minmax error, the maximum deviation from the true function in the same range, is minimum; in order to achieve a better approximation, one needs a higher polynomial order <inline-formula><tex-math notation="LaTeX" id="ImEquation138"><![CDATA[$N$]]></tex-math></inline-formula>. Since the (shifted) Chebyshev polynomials <inline-formula><tex-math notation="LaTeX" id="ImEquation139"><![CDATA[$T_j^*(x)$]]></tex-math></inline-formula> are oscillating functions between 0 and 1, it is necessary to use larger <inline-formula><tex-math notation="LaTeX" id="ImEquation140"><![CDATA[$N$]]></tex-math></inline-formula> in order to better approximate the detailed shape of the original spectral function <inline-formula><tex-math notation="LaTeX" id="ImEquation141"><![CDATA[$\bar\rho(\omega)$]]></tex-math></inline-formula> by narrowing the width <inline-formula><tex-math notation="LaTeX" id="ImEquation142"><![CDATA[$\Delta$]]></tex-math></inline-formula> of the smearing kernel. The approximation is demonstrated in the next section by taking a few examples.</p>
<p>The shifted Chebyshev approximation works only when the argument <inline-formula><tex-math notation="LaTeX" id="ImEquation143"><![CDATA[$x$]]></tex-math></inline-formula> is in <inline-formula><tex-math notation="LaTeX" id="ImEquation144"><![CDATA[$0\le x\le 1$]]></tex-math></inline-formula>. In our case, it corresponds to the condition that the eigenvalues of <inline-formula><tex-math notation="LaTeX" id="ImEquation145"><![CDATA[$\hat{z}$]]></tex-math></inline-formula> are in <inline-formula><tex-math notation="LaTeX" id="ImEquation146"><![CDATA[$[0,1]$]]></tex-math></inline-formula>, which should be satisfied because <inline-formula><tex-math notation="LaTeX" id="ImEquation147"><![CDATA[$\hat{z}$]]></tex-math></inline-formula> is the transfer matrix <inline-formula><tex-math notation="LaTeX" id="ImEquation148"><![CDATA[$\hat{z}=e^{-\hat{H}}$]]></tex-math></inline-formula>. For a given eigenvalue <inline-formula><tex-math notation="LaTeX" id="ImEquation149"><![CDATA[$z_i$]]></tex-math></inline-formula> of <inline-formula><tex-math notation="LaTeX" id="ImEquation150"><![CDATA[$\hat{z}$]]></tex-math></inline-formula>, each polynomial <inline-formula><tex-math notation="LaTeX" id="ImEquation151"><![CDATA[$T_j^*(z_i)$]]></tex-math></inline-formula> takes a value between <inline-formula><tex-math notation="LaTeX" id="ImEquation152"><![CDATA[$-1$]]></tex-math></inline-formula> and <inline-formula><tex-math notation="LaTeX" id="ImEquation153"><![CDATA[$1$]]></tex-math></inline-formula>, and if the state <inline-formula><tex-math notation="LaTeX" id="ImEquation154"><![CDATA[$|\psi\rangle$]]></tex-math></inline-formula> is decomposed as <inline-formula><tex-math notation="LaTeX" id="ImEquation155"><![CDATA[$|\psi\rangle=\sum_ia_i|i\rangle$]]></tex-math></inline-formula> with a normalization <inline-formula><tex-math notation="LaTeX" id="ImEquation156"><![CDATA[$\sum_i|a_i|^2=\langle\psi|\psi\rangle$]]></tex-math></inline-formula>, the individual polynomial becomes <inline-formula><tex-math notation="LaTeX" id="ImEquation157"><![CDATA[$\langle\psi|T_j^*(\hat{z})|\psi\rangle =\sum_i|a_i|^2 T_j^*(z_i)$]]></tex-math></inline-formula>, which is bounded by <inline-formula><tex-math notation="LaTeX" id="ImEquation158"><![CDATA[$\pm\sum_i|a_i|^2=\pm\langle\psi|\psi\rangle$]]></tex-math></inline-formula> so that <inline-formula><tex-math notation="LaTeX" id="ImEquation159"><![CDATA[$\langle T_j^*(\hat{z})\rangle$]]></tex-math></inline-formula> is bounded by <inline-formula><tex-math notation="LaTeX" id="ImEquation160"><![CDATA[$\pm 1$]]></tex-math></inline-formula>. This provides a non-trivial constraint that must be satisfied by the correlator <inline-formula><tex-math notation="LaTeX" id="ImEquation161"><![CDATA[$\bar{C}(t)$]]></tex-math></inline-formula>.</p>
</sec>
<sec id="SEC3"><title>3. Chebyshev polynomial approximation: examples</title>
<p>First, we demonstrate how well the smearing kernel <inline-formula><tex-math notation="LaTeX" id="ImEquation162"><![CDATA[$S_\Delta(\omega,\omega')$]]></tex-math></inline-formula>, Eq. (<xref ref-type="disp-formula" rid="ptaa044M15">15</xref>), is approximated by the Chebyshev polynomials. Setting <inline-formula><tex-math notation="LaTeX" id="ImEquation163"><![CDATA[$\omega'=\omega_0$]]></tex-math></inline-formula> = 1, in some unit, say the lattice unit, we draw a curve of <inline-formula><tex-math notation="LaTeX" id="ImEquation164"><![CDATA[$S_\Delta(\omega,\omega_0)$]]></tex-math></inline-formula> in <xref ref-type="fig" rid="F1">Fig. 1</xref> (left). The Chebyshev approximation of the form (<xref ref-type="disp-formula" rid="ptaa044M16">16</xref>), replacing <inline-formula><tex-math notation="LaTeX" id="ImEquation165"><![CDATA[$\hat{z}$]]></tex-math></inline-formula> by <inline-formula><tex-math notation="LaTeX" id="ImEquation166"><![CDATA[$e^{-\omega_0}$]]></tex-math></inline-formula> in this equation, is also plotted for <inline-formula><tex-math notation="LaTeX" id="ImEquation167"><![CDATA[$N$]]></tex-math></inline-formula> = 10 (dotted), 15 (dot-dashed), and 20 (dashed curve). In the right panels, we plot the error of the approximation, namely a difference from the true function <inline-formula><tex-math notation="LaTeX" id="ImEquation168"><![CDATA[$S_\Delta^{\rm (approx)}(\omega,\omega_0)- S_\Delta^{\rm (true)}(\omega,\omega_0)$]]></tex-math></inline-formula>.</p>
<fig id="F1" orientation="portrait" position="float"><label>Fig. 1.</label><caption><p>Left: Chebyshev approximation of the smearing kernel <inline-formula><tex-math notation="LaTeX" id="ImEquation169"><![CDATA[$S_\Delta(\omega,\omega_0)$]]></tex-math></inline-formula> for <inline-formula><tex-math notation="LaTeX" id="ImEquation170"><![CDATA[$\omega_0=1$]]></tex-math></inline-formula> and <inline-formula><tex-math notation="LaTeX" id="ImEquation171"><![CDATA[$\Delta$]]></tex-math></inline-formula> = 0.1 (top), 0.2 (middle), and 0.3 (bottom). The solid line is the true function, while the dotted, dot-dashed, and dashed lines are the approximations with <inline-formula><tex-math notation="LaTeX" id="ImEquation172"><![CDATA[$N$]]></tex-math></inline-formula> = 10, 15, and 20, respectively. Right: Its error compared to the true function.</p></caption>
<graphic xmlns:xlink="http://www.w3.org/1999/xlink" orientation="portrait" position="float" mimetype="image" xlink:href="ptaa044f1.tif"/></fig>
<p>From the plots in <xref ref-type="fig" rid="F1">Fig. 1</xref> one can confirm that the smearing function with a larger width <inline-formula><tex-math notation="LaTeX" id="ImEquation173"><![CDATA[$\Delta = 0.3$]]></tex-math></inline-formula> is well approximated by a limited order of the polynomials. Namely, the polynomials up to order <inline-formula><tex-math notation="LaTeX" id="ImEquation174"><![CDATA[$N = 20$]]></tex-math></inline-formula> or even 15 give a nearly perfect approximation; the deviation is at the level of a few %. Apparently, the approximation becomes poorer when the function is sharper, <inline-formula><tex-math notation="LaTeX" id="ImEquation175"><![CDATA[$\Delta = 0.2$]]></tex-math></inline-formula> or 0.1. One needs higher-order polynomials to achieve a better approximation. We limit ourselves to <inline-formula><tex-math notation="LaTeX" id="ImEquation176"><![CDATA[$N$]]></tex-math></inline-formula> = 10&#x2013;20, because these are the orders that can be practically used for the analysis of lattice data, as we discuss in the next section.</p>
<p>When the target energy <inline-formula><tex-math notation="LaTeX" id="ImEquation177"><![CDATA[$\omega_0$]]></tex-math></inline-formula> is lower, <inline-formula><tex-math notation="LaTeX" id="ImEquation178"><![CDATA[$\omega_0$]]></tex-math></inline-formula> = 0.5, we observe a very similar pattern as shown in <xref ref-type="fig" rid="F2">Fig. 2</xref>. An important difference is, however, that the approximation is better than those for <inline-formula><tex-math notation="LaTeX" id="ImEquation179"><![CDATA[$\omega_0$]]></tex-math></inline-formula> = 1.0, as one can see by comparing the size of the error <inline-formula><tex-math notation="LaTeX" id="ImEquation180"><![CDATA[$S_\Delta^{\rm (approx)}(\omega,\omega_0)- S_\Delta^{\rm (true)}(\omega,\omega_0)$]]></tex-math></inline-formula>. This is probably because the approximation is constructed as a function of <inline-formula><tex-math notation="LaTeX" id="ImEquation181"><![CDATA[$z=e^{-\omega}$]]></tex-math></inline-formula>, and the Chebyshev approximation works uniformly between <inline-formula><tex-math notation="LaTeX" id="ImEquation182"><![CDATA[$z\in[0,1]$]]></tex-math></inline-formula>. The range of <inline-formula><tex-math notation="LaTeX" id="ImEquation183"><![CDATA[$\omega\in[0.5,1.5]$]]></tex-math></inline-formula>, which is the central region for <inline-formula><tex-math notation="LaTeX" id="ImEquation184"><![CDATA[$\omega_0=1$]]></tex-math></inline-formula>, is mapped onto <inline-formula><tex-math notation="LaTeX" id="ImEquation185"><![CDATA[$z\sim[0.22,0.61]$]]></tex-math></inline-formula>, while <inline-formula><tex-math notation="LaTeX" id="ImEquation186"><![CDATA[$\omega\in[0,1]$]]></tex-math></inline-formula>, for <inline-formula><tex-math notation="LaTeX" id="ImEquation187"><![CDATA[$\omega_0=0.5$]]></tex-math></inline-formula>, corresponds to <inline-formula><tex-math notation="LaTeX" id="ImEquation188"><![CDATA[$z\sim[0.37,1]$]]></tex-math></inline-formula>, which stretches over a wider range and the Chebyshev approximation works more efficiently.</p>
<fig id="F2" orientation="portrait" position="float"><label>Fig. 2.</label><caption><p>Same as <xref ref-type="fig" rid="F1">Fig. 1</xref> but for <inline-formula><tex-math notation="LaTeX" id="ImEquation189"><![CDATA[$\omega_0$]]></tex-math></inline-formula> = 0.5.</p></caption>
<graphic xmlns:xlink="http://www.w3.org/1999/xlink" orientation="portrait" position="float" mimetype="image" xlink:href="ptaa044f2.tif"/></fig>
<p>In order to see the rate of convergence of the Chebyshev approximation, we plot the coefficients <inline-formula><tex-math notation="LaTeX" id="ImEquation190"><![CDATA[$c_j^*(\omega)$]]></tex-math></inline-formula> as a function of <inline-formula><tex-math notation="LaTeX" id="ImEquation191"><![CDATA[$j$]]></tex-math></inline-formula> in <xref ref-type="fig" rid="F3">Fig. 3</xref>. As an example, the point <inline-formula><tex-math notation="LaTeX" id="ImEquation192"><![CDATA[$\omega=\omega_0$]]></tex-math></inline-formula> is taken because this is where the error is largest. (This is not always the case, especially when the approximation is already good. See Figs. <xref ref-type="fig" rid="F1">1</xref> and <xref ref-type="fig" rid="F2">2</xref>.) One can see that the magnitude of the coefficient <inline-formula><tex-math notation="LaTeX" id="ImEquation193"><![CDATA[$|c_j^*(\omega)|$]]></tex-math></inline-formula> decreases roughly exponentially as <inline-formula><tex-math notation="LaTeX" id="ImEquation194"><![CDATA[$j$]]></tex-math></inline-formula>. When the approximation is better (larger <inline-formula><tex-math notation="LaTeX" id="ImEquation195"><![CDATA[$\Delta$]]></tex-math></inline-formula>), the decrease of <inline-formula><tex-math notation="LaTeX" id="ImEquation196"><![CDATA[$|c_j^*(\omega)|$]]></tex-math></inline-formula> is faster. Since the Chebyshev polynomial <inline-formula><tex-math notation="LaTeX" id="ImEquation197"><![CDATA[$|\langle T_j^*(\hat{z})\rangle|$]]></tex-math></inline-formula> is bounded from above by 1, this shows (the upper limit of) the rate of convergence. The calculation of <inline-formula><tex-math notation="LaTeX" id="ImEquation198"><![CDATA[$c_j^*(\omega)$]]></tex-math></inline-formula> is numerically inexpensive, and one can easily estimate the error of the approximation due to a truncation at the order <inline-formula><tex-math notation="LaTeX" id="ImEquation199"><![CDATA[$N$]]></tex-math></inline-formula> by <inline-formula><tex-math notation="LaTeX" id="ImEquation200"><![CDATA[$\pm|c_{N+1}^*(\omega)|$]]></tex-math></inline-formula>.</p>
<fig id="F3" orientation="portrait" position="float"><label>Fig. 3.</label><caption><p>Coefficient of the Chebyshev approximation <inline-formula><tex-math notation="LaTeX" id="ImEquation201"><![CDATA[$c_j^*(\omega)$]]></tex-math></inline-formula> at <inline-formula><tex-math notation="LaTeX" id="ImEquation202"><![CDATA[$\omega=\omega_0$]]></tex-math></inline-formula> plotted against <inline-formula><tex-math notation="LaTeX" id="ImEquation203"><![CDATA[$j$]]></tex-math></inline-formula> for <inline-formula><tex-math notation="LaTeX" id="ImEquation204"><![CDATA[$\omega_0$]]></tex-math></inline-formula> = 1.0 (left) and 0.5 (right). Results for <inline-formula><tex-math notation="LaTeX" id="ImEquation205"><![CDATA[$\Delta$]]></tex-math></inline-formula> = 0.1 (squares), 0.2 (triangles), and 0.3 (circles).</p></caption>
<graphic xmlns:xlink="http://www.w3.org/1999/xlink" orientation="portrait" position="float" mimetype="image" xlink:href="ptaa044f3.tif"/></fig>
<p>As another test, we consider the Laplace transform (<xref ref-type="disp-formula" rid="ptaa044M4">4</xref>), which is achieved by a smearing kernel:
<disp-formula id="ptaa044M23"><label>(23)</label><tex-math notation="LaTeX" id="Equation23"><![CDATA[$$\begin{equation}
\label{eq:Laplace_smearing}
S_{\rm Lap}(M^2,\omega') = \frac{2\omega'}{M^2} e^{-\omega'^2/M^2}.
\end{equation}$$]]></tex-math></disp-formula></p>
<p>In <xref ref-type="fig" rid="F4">Fig. 4</xref> we draw a curve of <inline-formula><tex-math notation="LaTeX" id="ImEquation206"><![CDATA[$S_{\rm Lap}(M^2,\omega_0)$]]></tex-math></inline-formula>, which represents a convolution with a trivial spectrum <inline-formula><tex-math notation="LaTeX" id="ImEquation207"><![CDATA[$\delta(\omega'-\omega_0)$]]></tex-math></inline-formula>, together with its approximations (<xref ref-type="disp-formula" rid="ptaa044M21">21</xref>). The plots for <inline-formula><tex-math notation="LaTeX" id="ImEquation208"><![CDATA[$\omega_0$]]></tex-math></inline-formula> = 1.0 (left) and 0.5 (right) demonstrate that the Chebyshev polynomials provide a very precise approximation even with <inline-formula><tex-math notation="LaTeX" id="ImEquation209"><![CDATA[$N$]]></tex-math></inline-formula> = 10. This is not unreasonable because the Laplace transform is a smooth function over the entire range of energy.</p>
<fig id="F4" orientation="portrait" position="float"><label>Fig. 4.</label><caption><p>Chebyshev approximation of the kernel <inline-formula><tex-math notation="LaTeX" id="ImEquation210"><![CDATA[$S_{\rm Lap}(M^2,\omega_0)$]]></tex-math></inline-formula> corresponding to the Laplace transform as a function of <inline-formula><tex-math notation="LaTeX" id="ImEquation211"><![CDATA[$1/M^2$]]></tex-math></inline-formula>. The true function (solid line) as well as its approximations (dotted, dot-dashed, dashed) are shown for <inline-formula><tex-math notation="LaTeX" id="ImEquation212"><![CDATA[$\omega_0$]]></tex-math></inline-formula> = 1.0 (left) and 0.5 (right).</p></caption>
<graphic xmlns:xlink="http://www.w3.org/1999/xlink" orientation="portrait" position="float" mimetype="image" xlink:href="ptaa044f4.tif"/></fig>
<p>We note that the comparison given in this section corresponds to the extreme case of having a single state only, i.e., <inline-formula><tex-math notation="LaTeX" id="ImEquation213"><![CDATA[$\bar{\rho}(\omega)=\delta(\omega-\omega_0)$]]></tex-math></inline-formula>, so that the correlator is represented by a single exponential function <inline-formula><tex-math notation="LaTeX" id="ImEquation214"><![CDATA[$\bar{C}(t)=e^{-\omega_0 t}$]]></tex-math></inline-formula>. More realistic cases of having more than one state can be given by a sum of <inline-formula><tex-math notation="LaTeX" id="ImEquation215"><![CDATA[$S_\Delta(\omega,\omega_0)$]]></tex-math></inline-formula> with some weights at various <inline-formula><tex-math notation="LaTeX" id="ImEquation216"><![CDATA[$\omega_0$]]></tex-math></inline-formula>. The comparison between the approximated and true functions then becomes more complicated. However, when the approximation is good for all possible values of <inline-formula><tex-math notation="LaTeX" id="ImEquation217"><![CDATA[$\omega_0$]]></tex-math></inline-formula>, the overall function is also well approximated. What we demonstrate in this section is a comparison at two representative values of <inline-formula><tex-math notation="LaTeX" id="ImEquation218"><![CDATA[$\omega_0$]]></tex-math></inline-formula>, 0.5 and 1.0, which allow one to get some idea about the size of the error that may remain for general cases. For a more precise error analysis, one can even derive a bound on the error when the unsmeared spectral function is assumed.</p>
<p>The physical spectrum in the infinite volume is a continuous function of <inline-formula><tex-math notation="LaTeX" id="ImEquation219"><![CDATA[$\omega'$]]></tex-math></inline-formula>. It is defined by an infinite volume limit of the spectral function in the finite volume, which is given by a sum of many <inline-formula><tex-math notation="LaTeX" id="ImEquation220"><![CDATA[$\delta$]]></tex-math></inline-formula>-functions. The smeared spectral function is nothing but a weighted sum of such a function, which is interchangeable with the infinite volume limit since no divergence is expected. The Chebyshev approximation is thus a well-defined procedure for the cases of both finite and infinite volumes.</p>
<p>We emphasize that the test of the Chebyshev approximation is independent of statistical error. The statistical error determines which polynomial orders one can use, as we discuss with real data in the next section.</p>
</sec>
<sec id="SEC4"><title>4. Smeared spectral function from lattice data: charmonium correlators</title>
<p>We test the method with LQCD data for charmonium correlators. Our data are obtained on the lattice with 2+1 flavors of M&#x00F6;bius domain-wall fermions. They have been previously used for an extraction of the charm quark mass from the charmonium temporal moments [<xref ref-type="bibr" rid="B14">14</xref>]. (The same lattice ensembles are also used for calculations of the Dirac spectrum [<xref ref-type="bibr" rid="B15">15</xref>,<xref ref-type="bibr" rid="B16">16</xref>], short-distance current correlators [<xref ref-type="bibr" rid="B17">17</xref>], topological susceptibility [<xref ref-type="bibr" rid="B18">18</xref>], and <inline-formula><tex-math notation="LaTeX" id="ImEquation221"><![CDATA[$\eta'$]]></tex-math></inline-formula> meson mass [<xref ref-type="bibr" rid="B19">19</xref>].) Among 15 ensembles generated at various lattice spacings and lattice sizes, we use the one at a lattice spacing <inline-formula><tex-math notation="LaTeX" id="ImEquation222"><![CDATA[$a$]]></tex-math></inline-formula> = 0.080 fm, a lattice size <inline-formula><tex-math notation="LaTeX" id="ImEquation223"><![CDATA[$32^3\times 64$]]></tex-math></inline-formula>, and bare quark masses <inline-formula><tex-math notation="LaTeX" id="ImEquation224"><![CDATA[$am_{ud}$]]></tex-math></inline-formula> = 0.007 and <inline-formula><tex-math notation="LaTeX" id="ImEquation225"><![CDATA[$am_s$]]></tex-math></inline-formula> = 0.040. The corresponding pion mass is 309(1) MeV. We take 100 gauge configurations and calculate the charmonium correlator with a tuned charm quark mass <inline-formula><tex-math notation="LaTeX" id="ImEquation226"><![CDATA[$am_c = 0.440\,37$]]></tex-math></inline-formula>, and compute charm quark propagators from <inline-formula><tex-math notation="LaTeX" id="ImEquation227"><![CDATA[$Z_2$]]></tex-math></inline-formula> noises distributed over a time slice to construct charmonium correlators. We then construct the charmonium correlators, which correspond to those of local currents in the pseudo-scalar (PP) and vector (VV) channels. This calculation has been repeated for 8 source time slices to improve the statistical signal, so that the total number of measurements is 800. Three spatial polarizations are averaged for the VV channel.</p>
<p><xref ref-type="fig" rid="F5">Figure 5</xref> shows the effective mass <inline-formula><tex-math notation="LaTeX" id="ImEquation228"><![CDATA[$E_{\rm eff}(t)=\ln[C(t)/C(t+1)]$]]></tex-math></inline-formula>. We observe that the correlator is nearly saturated by the ground state at around <inline-formula><tex-math notation="LaTeX" id="ImEquation229"><![CDATA[$t=18$]]></tex-math></inline-formula>, and the information on the excited states is encoded in the region of smaller <inline-formula><tex-math notation="LaTeX" id="ImEquation230"><![CDATA[$t$]]></tex-math></inline-formula>. Energy levels and amplitudes obtained by a multi-exponential fit of the form <inline-formula><tex-math notation="LaTeX" id="ImEquation231"><![CDATA[$C(t)=\sum_iA_ie^{-E_it}$]]></tex-math></inline-formula> are given in <xref ref-type="table" rid="T1">Table 1</xref>. We include four levels in the fit, yet show the results only up to three levels since the error of the third amplitude is already large. Statistical correlation among different <inline-formula><tex-math notation="LaTeX" id="ImEquation232"><![CDATA[$t$]]></tex-math></inline-formula> is taken into account in the fit. The results for the three lowest energy levels are stable within one standard deviation against a change of the fit range, e.g., the lower limit <inline-formula><tex-math notation="LaTeX" id="ImEquation233"><![CDATA[$t_{\rm min}$]]></tex-math></inline-formula> varied from 4 to 14. The results reproduce the experimental data reasonably well. For instance, the lowest-lying vector meson masses are 3.09 and 3.76(19) GeV, which correspond to the experimentally observed <inline-formula><tex-math notation="LaTeX" id="ImEquation234"><![CDATA[$J/\psi$]]></tex-math></inline-formula> and <inline-formula><tex-math notation="LaTeX" id="ImEquation235"><![CDATA[$\psi(2S)$]]></tex-math></inline-formula> states of masses 3.10 and 3.69 GeV, respectively. The results obtained here are used as references for the study of smeared spectral functions.</p>
<fig id="F5" orientation="portrait" position="float"><label>Fig. 5.</label><caption><p>Effective mass of the pseudo-scalar (circles) and vector (squares) correlators calculated on the lattice with lattice cutoff <inline-formula><tex-math notation="LaTeX" id="ImEquation236"><![CDATA[$1/a$]]></tex-math></inline-formula> = 2.453(4) GeV. The charm quark mass is tuned such that the spin-averaged <inline-formula><tex-math notation="LaTeX" id="ImEquation237"><![CDATA[$1S$]]></tex-math></inline-formula> mass matches the experimental data.</p></caption>
<graphic xmlns:xlink="http://www.w3.org/1999/xlink" orientation="portrait" position="float" mimetype="image" xlink:href="ptaa044f5.tif"/></fig>
<table-wrap id="T1" orientation="portrait" position="float"><label>Table 1.</label>
<caption><p>Energy levels and amplitudes for the charmonium correlators. Lattice data are fitted to four exponential functions with <inline-formula><tex-math notation="LaTeX" id="ImEquation238"><![CDATA[$t_{\mathrm{min}}$]]></tex-math></inline-formula> = 4.</p></caption>
<table frame="hsides" rules="groups">
<thead>
<tr>
<th align="left"></th>
<th align="center" colspan="2">PP channel</th>
<th align="center" colspan="2">VV channel</th>
</tr>
<tr>
<th align="left"><inline-formula><tex-math notation="LaTeX" id="ImEquation239"><![CDATA[$i$]]></tex-math></inline-formula></th>
<th align="center"><inline-formula><tex-math notation="LaTeX" id="ImEquation240"><![CDATA[$E_i $]]></tex-math></inline-formula></th>
<th align="center"><inline-formula><tex-math notation="LaTeX" id="ImEquation241"><![CDATA[$A_i$]]></tex-math></inline-formula></th>
<th align="center"><inline-formula><tex-math notation="LaTeX" id="ImEquation242"><![CDATA[$E_i$]]></tex-math></inline-formula></th>
<th align="center"><inline-formula><tex-math notation="LaTeX" id="ImEquation243"><![CDATA[$A_i$]]></tex-math></inline-formula>
</th>
</tr>
</thead>
<tbody>
<tr>
<td align="left">0</td>
<td align="center">1.225 76(18)</td>
<td align="center">0.176 38(31)</td>
<td align="center">1.258 9(17)</td>
<td align="center">0.1308(35)</td>
</tr>
<tr>
<td align="left">1</td>
<td align="center">1.521(19)</td>
<td align="center">0.205(22)</td>
<td align="center">1.534(79)</td>
<td align="center">0.184(62)</td>
</tr>
<tr>
<td align="left">2</td>
<td align="center">1.831(15)</td>
<td align="center">0.25(17)</td>
<td align="center">1.834(15)</td>
<td align="center">0.04(88)</td>
</tr>
</tbody>
</table>
</table-wrap>
<p>We construct the Chebyshev matrix elements <inline-formula><tex-math notation="LaTeX" id="ImEquation244"><![CDATA[$\langle T_j^*(\hat{z})\rangle$]]></tex-math></inline-formula> defined in Eq. (<xref ref-type="disp-formula" rid="ptaa044M21">21</xref>) from the current correlators. The calculation is straightforward. Namely, we replace the term of <inline-formula><tex-math notation="LaTeX" id="ImEquation245"><![CDATA[$\hat{z}^t$]]></tex-math></inline-formula> in the polynomials by <inline-formula><tex-math notation="LaTeX" id="ImEquation246"><![CDATA[$C(t+2t_0)/C(2t_0)$]]></tex-math></inline-formula> and calculate the linear combinations of them with the coefficients of the shifted Chebyshev polynomials. We take <inline-formula><tex-math notation="LaTeX" id="ImEquation247"><![CDATA[$t_0=1$]]></tex-math></inline-formula> in the lattice unit. The results are shown in <xref ref-type="fig" rid="F6">Fig. 6</xref>; the error is calculated using the jackknife method. It turns out that the Chebyshev matrix elements are precisely determined up to <inline-formula><tex-math notation="LaTeX" id="ImEquation248"><![CDATA[$j=11$]]></tex-math></inline-formula>, which corresponds to <inline-formula><tex-math notation="LaTeX" id="ImEquation249"><![CDATA[$t=13$]]></tex-math></inline-formula>. Beyond that point, the statistical error grows rapidly, and the results eventually get out of the range of <inline-formula><tex-math notation="LaTeX" id="ImEquation250"><![CDATA[$\pm 1$]]></tex-math></inline-formula>, which must be satisfied for the Chebyshev polynomials.</p>
<fig id="F6" orientation="portrait" position="float"><label>Fig. 6.</label><caption><p>Chebyshev matrix elements <inline-formula><tex-math notation="LaTeX" id="ImEquation251"><![CDATA[$\langle T_j^*(\hat{z})\rangle$]]></tex-math></inline-formula> for the PP (circles) and VV (squares) charmonium correlators. The VV points are slightly shifted horizontally for clarity. The statistical error is estimated using the jackknife method.</p></caption>
<graphic xmlns:xlink="http://www.w3.org/1999/xlink" orientation="portrait" position="float" mimetype="image" xlink:href="ptaa044f6.tif"/></fig>
<p>In fact, the statistical error grows exponentially for higher-order polynomials as shown in <xref ref-type="fig" rid="F7">Fig. 7</xref>. Its growth rate is about a factor of three to proceed by another order in <inline-formula><tex-math notation="LaTeX" id="ImEquation252"><![CDATA[$j$]]></tex-math></inline-formula>, which means that 10 times larger statistical samples would be needed to include yet another order to improve the Chebyshev approximation. This is not unreasonable because we try to construct the quantities of <inline-formula><tex-math notation="LaTeX" id="ImEquation253"><![CDATA[$O(1)$]]></tex-math></inline-formula> as a linear combination of terms of exponentially different orders. For the charmonium correlator at the lattice spacing chosen in this work, the terms of <inline-formula><tex-math notation="LaTeX" id="ImEquation254"><![CDATA[$\hat{z}^t$]]></tex-math></inline-formula> are suppressed roughly by <inline-formula><tex-math notation="LaTeX" id="ImEquation255"><![CDATA[$e^{-1.2t}$]]></tex-math></inline-formula>, which is, however, compensated by the Chebyshev coefficients growing even faster. In the end, a strong cancellation among different powers of <inline-formula><tex-math notation="LaTeX" id="ImEquation256"><![CDATA[$\hat{z}$]]></tex-math></inline-formula> gives a number between <inline-formula><tex-math notation="LaTeX" id="ImEquation257"><![CDATA[$-1$]]></tex-math></inline-formula> and <inline-formula><tex-math notation="LaTeX" id="ImEquation258"><![CDATA[$+1$]]></tex-math></inline-formula>, and the noise is relatively enhanced. For instance, at the order <inline-formula><tex-math notation="LaTeX" id="ImEquation259"><![CDATA[$j=12$]]></tex-math></inline-formula>, a cancellation of four orders of magnitude takes place and it becomes even harder for higher orders.</p>
<fig id="F7" orientation="portrait" position="float"><label>Fig. 7.</label><caption><p>Statistical error of <inline-formula><tex-math notation="LaTeX" id="ImEquation260"><![CDATA[$\langle T_j^*(\hat{z})\rangle$]]></tex-math></inline-formula> as a function of <inline-formula><tex-math notation="LaTeX" id="ImEquation261"><![CDATA[$j$]]></tex-math></inline-formula>. Circles and squares represent the data for PP and VV channels, respectively.</p></caption>
<graphic xmlns:xlink="http://www.w3.org/1999/xlink" orientation="portrait" position="float" mimetype="image" xlink:href="ptaa044f7.tif"/></fig>
<p>Since the Chebyshev approximation drastically fails outside the domain <inline-formula><tex-math notation="LaTeX" id="ImEquation262"><![CDATA[$0\le x\le 1$]]></tex-math></inline-formula>, we are not able to use it beyond the order where <inline-formula><tex-math notation="LaTeX" id="ImEquation263"><![CDATA[$|\langle T_j^*(\hat{z})\rangle|$]]></tex-math></inline-formula> exceeds 1. Instead, we introduce a fit to determine these matrix elements <inline-formula><tex-math notation="LaTeX" id="ImEquation264"><![CDATA[$\bar{T}_j\equiv\langle T_j^*(\hat{z})\rangle$]]></tex-math></inline-formula> in such a way that they are consistent with <inline-formula><tex-math notation="LaTeX" id="ImEquation265"><![CDATA[$\bar{C}(t)$]]></tex-math></inline-formula> while satisfying a constraint <inline-formula><tex-math notation="LaTeX" id="ImEquation266"><![CDATA[$|\bar{T}_j|\le 1$]]></tex-math></inline-formula>. To do so, we can use the reverse formula of the shifted Chebyshev polynomials [<xref ref-type="bibr" rid="B20">20</xref>]:
<disp-formula id="ptaa044M24"><label>(24)</label><tex-math notation="LaTeX" id="Equation24"><![CDATA[$$\begin{equation}
\label{eq:reverse_Cheb}
x^n = 2^{1-2n}\sideset{}{'}\sum_{r=0}^n \left(
\begin{array}[c]{c}
2n\\ n-r
\end{array}
\right)
T_r^*(x),
\end{equation}$$]]></tex-math></disp-formula>
where the prime on the sum indicates that the term of <inline-formula><tex-math notation="LaTeX" id="ImEquation267"><![CDATA[$r=0$]]></tex-math></inline-formula> is to be halved. The relation to be satisfied is then
<disp-formula id="ptaa044M25"><label>(25)</label><tex-math notation="LaTeX" id="Equation25"><![CDATA[$$\begin{equation}
\label{eq:to_fit}
\bar{C}(t) = 2^{1-2t}
\left[
\frac{1}{2}\left(\begin{array}[c]{c} 2t\\t\end{array}\right)
+ \sum_{r=1}^t\left(
\begin{array}[c]{c} 2t\\t-r\end{array}
\right)\bar{T}_r
\right].
\end{equation}$$]]></tex-math></disp-formula></p>
<p>We take <inline-formula><tex-math notation="LaTeX" id="ImEquation268"><![CDATA[$T_r^*$]]></tex-math></inline-formula> as free parameters to be determined and fit the lattice data <inline-formula><tex-math notation="LaTeX" id="ImEquation269"><![CDATA[$\bar{C}(t)$]]></tex-math></inline-formula> with a constraint <inline-formula><tex-math notation="LaTeX" id="ImEquation270"><![CDATA[$|\bar{T}_j|\le 1$]]></tex-math></inline-formula>. Statistical correlations of <inline-formula><tex-math notation="LaTeX" id="ImEquation271"><![CDATA[$C(t)$]]></tex-math></inline-formula> among different <inline-formula><tex-math notation="LaTeX" id="ImEquation272"><![CDATA[$t$]]></tex-math></inline-formula> are taken into account in the fit using the least-squares fit package lsqfit by Lepage [<xref ref-type="bibr" rid="B21">21</xref>]. The resulting values of <inline-formula><tex-math notation="LaTeX" id="ImEquation273"><![CDATA[$\bar{T}_j$]]></tex-math></inline-formula> are listed in <xref ref-type="table" rid="T2">Table 2</xref>. Since the numbers of inputs, <inline-formula><tex-math notation="LaTeX" id="ImEquation274"><![CDATA[$\bar{C}(t)$]]></tex-math></inline-formula>, and unknowns, <inline-formula><tex-math notation="LaTeX" id="ImEquation275"><![CDATA[$\bar{T}_j$]]></tex-math></inline-formula>, are the same, the condition (<xref ref-type="disp-formula" rid="ptaa044M25">25</xref>) may be solved as a system of linear equations unless the constraints are introduced. In fact, the results are unchanged from the direct determination through Eq. (<xref ref-type="disp-formula" rid="ptaa044M22">22</xref>) within the statistical error for small <inline-formula><tex-math notation="LaTeX" id="ImEquation276"><![CDATA[$j$]]></tex-math></inline-formula> up to <inline-formula><tex-math notation="LaTeX" id="ImEquation277"><![CDATA[$j\simeq 10$]]></tex-math></inline-formula>. Beyond that, they are affected by the constraints. The error becomes large, of order 1, for large <inline-formula><tex-math notation="LaTeX" id="ImEquation278"><![CDATA[$j$]]></tex-math></inline-formula>, where they are essentially undetermined by the fit but still kept within <inline-formula><tex-math notation="LaTeX" id="ImEquation279"><![CDATA[$\pm 1$]]></tex-math></inline-formula>.</p>
<table-wrap id="T2" orientation="portrait" position="float"><label>Table 2.</label>
<caption><p>Fit results for <inline-formula><tex-math notation="LaTeX" id="ImEquation280"><![CDATA[$\bar{T}_j$]]></tex-math></inline-formula>.</p></caption>
<table frame="hsides" rules="groups">
<thead>
<tr>
<th align="left"><inline-formula><tex-math notation="LaTeX" id="ImEquation281"><![CDATA[$j$]]></tex-math></inline-formula></th>
<th align="center">PP channel</th>
<th align="center">VV channel</th>
</tr>
</thead>
<tbody>
<tr>
<td align="left">1</td>
<td align="center">-0.6157(17)</td>
<td align="center">-0.6447(17)</td>
</tr>
<tr>
<td align="left">2</td>
<td align="center">-0.1933(48)</td>
<td align="center">-0.1257(49)</td>
</tr>
<tr>
<td align="left">3</td>
<td align="center">0.7341(61)</td>
<td align="center">0.6980(63)</td>
</tr>
<tr>
<td align="left">4</td>
<td align="center">-0.6262(46)</td>
<td align="center">-0.6892(49)</td>
</tr>
<tr>
<td align="left">5</td>
<td align="center">0.1090(35)</td>
<td align="center">0.2410(43)</td>
</tr>
<tr>
<td align="left">6</td>
<td align="center">0.2803(72)</td>
<td align="center">0.1914(78)</td>
</tr>
<tr>
<td align="left">7</td>
<td align="center">-0.267(17)</td>
<td align="center">-0.297(17)</td>
</tr>
<tr>
<td align="left">8</td>
<td align="center">0.036(38)</td>
<td align="center">0.144(37)</td>
</tr>
<tr>
<td align="left">9</td>
<td align="center">0.073(81)</td>
<td align="center">-0.001(78)</td>
</tr>
<tr>
<td align="left">10</td>
<td align="center">0.03(16)</td>
<td align="center">0.01(15)</td>
</tr>
<tr>
<td align="left">11</td>
<td align="center">-0.14(26)</td>
<td align="center">-0.08(25)</td>
</tr>
<tr>
<td align="left">12</td>
<td align="center">0.08(36)</td>
<td align="center">0.07(35)</td>
</tr>
<tr>
<td align="left">13</td>
<td align="center">0.06(43)</td>
<td align="center">0.03(42)</td>
</tr>
<tr>
<td align="left">14</td>
<td align="center">-0.07(51)</td>
<td align="center">-0.05(51)</td>
</tr>
<tr>
<td align="left">15</td>
<td align="center">-0.05(60)</td>
<td align="center">-0.02(59)</td>
</tr>
<tr>
<td align="left">16</td>
<td align="center">-0.01(77)</td>
<td align="center">0.00(76)</td>
</tr>
</tbody>
</table>
</table-wrap>
<p>Once a set of estimates for <inline-formula><tex-math notation="LaTeX" id="ImEquation282"><![CDATA[$\langle T_j^*(\hat{z})\rangle$]]></tex-math></inline-formula>, i.e., <inline-formula><tex-math notation="LaTeX" id="ImEquation283"><![CDATA[$\bar{T}_j$]]></tex-math></inline-formula>, is obtained, the remaining task is to use Eq. (<xref ref-type="disp-formula" rid="ptaa044M21">21</xref>) to estimate <inline-formula><tex-math notation="LaTeX" id="ImEquation284"><![CDATA[$\bar{\rho}_\Delta(\omega)$]]></tex-math></inline-formula>. The results are shown in <xref ref-type="fig" rid="F8">Fig. 8</xref>. Three bands corresponding to the polynomial order <inline-formula><tex-math notation="LaTeX" id="ImEquation285"><![CDATA[$N$]]></tex-math></inline-formula> = 12 (red), 14 (blue), 16 (orange) are overlaid. We find that the overall shape is unchanged by adding more terms, i.e., from 12 to 14 or to 16, while the size and shape of the statistical error are affected. When the polynomial order is lower, some wiggle structure is observed, while the necks, the positions of small statistical error, are widened by adding more terms and eventually the error becomes nearly uniform over <inline-formula><tex-math notation="LaTeX" id="ImEquation286"><![CDATA[$\omega$]]></tex-math></inline-formula>. Beyond <inline-formula><tex-math notation="LaTeX" id="ImEquation287"><![CDATA[$N=16$]]></tex-math></inline-formula>, the results are essentially unchanged, since the higher-order coefficients <inline-formula><tex-math notation="LaTeX" id="ImEquation288"><![CDATA[$c_j^*(\omega)$]]></tex-math></inline-formula> are exponentially suppressed.</p>
<fig id="F8" orientation="portrait" position="float"><label>Fig. 8.</label><caption><p>Smeared spectral function <inline-formula><tex-math notation="LaTeX" id="ImEquation289"><![CDATA[$\bar{\rho}_\Delta(\omega)$]]></tex-math></inline-formula> reconstructed using Eq. (<xref ref-type="disp-formula" rid="ptaa044M21">21</xref>). The order of approximation is <inline-formula><tex-math notation="LaTeX" id="ImEquation290"><![CDATA[$N$]]></tex-math></inline-formula> = 12 (red), 14 (blue), 16 (orange). The results for <inline-formula><tex-math notation="LaTeX" id="ImEquation291"><![CDATA[$\Delta$]]></tex-math></inline-formula> = 0.1 (top panels) and 0.3 (bottom panels), for the PP channel (left panels) and VV channel (right panels), are shown.</p></caption>
<graphic xmlns:xlink="http://www.w3.org/1999/xlink" orientation="portrait" position="float" mimetype="image" xlink:href="ptaa044f8.tif"/></fig>
<p>In <xref ref-type="fig" rid="F9">Fig. 9</xref> we show the results for the smeared spectral function <inline-formula><tex-math notation="LaTeX" id="ImEquation292"><![CDATA[$\bar{\rho}_\Delta(\omega)$]]></tex-math></inline-formula> obtained with <inline-formula><tex-math notation="LaTeX" id="ImEquation293"><![CDATA[$N=16$]]></tex-math></inline-formula>. The smearing kernel is <inline-formula><tex-math notation="LaTeX" id="ImEquation294"><![CDATA[$S_\Delta(\omega,\omega')$]]></tex-math></inline-formula> with <inline-formula><tex-math notation="LaTeX" id="ImEquation295"><![CDATA[$\Delta$]]></tex-math></inline-formula> = 0.1 (top), 0.2 (middle), and 0.3 (bottom). The results are compared with the expected contributions from the ground state and first excited state (red and blue curves). They are drawn assuming <inline-formula><tex-math notation="LaTeX" id="ImEquation296"><![CDATA[$\delta$]]></tex-math></inline-formula>-function distributions, <inline-formula><tex-math notation="LaTeX" id="ImEquation297"><![CDATA[$\bar{\rho}(\omega')=\sum_i A_ie^{-2\omega't_0}\delta(\omega'-E_i)$]]></tex-math></inline-formula>, with the fitted values of energy levels <inline-formula><tex-math notation="LaTeX" id="ImEquation298"><![CDATA[$E_i$]]></tex-math></inline-formula> and their amplitudes <inline-formula><tex-math notation="LaTeX" id="ImEquation299"><![CDATA[$A_i$]]></tex-math></inline-formula> given in <xref ref-type="table" rid="T1">Table 1</xref>. The factor <inline-formula><tex-math notation="LaTeX" id="ImEquation300"><![CDATA[$e^{-2\omega't_0}$]]></tex-math></inline-formula> is introduced to take account of the time evolution from 0 to <inline-formula><tex-math notation="LaTeX" id="ImEquation301"><![CDATA[$t_0$]]></tex-math></inline-formula>, which is included in the definition of the state <inline-formula><tex-math notation="LaTeX" id="ImEquation302"><![CDATA[$|\psi\rangle=e^{-Ht_0}J_\mu|0\rangle$]]></tex-math></inline-formula>.</p>
<fig id="F9" orientation="portrait" position="float"><label>Fig. 9.</label><caption><p>Reconstructed smeared spectral function <inline-formula><tex-math notation="LaTeX" id="ImEquation303"><![CDATA[$\rho_\Delta(\omega)$]]></tex-math></inline-formula> for <inline-formula><tex-math notation="LaTeX" id="ImEquation304"><![CDATA[$\Delta$]]></tex-math></inline-formula> = 0.1 (top), 0.2 (middle), and 0.3 (bottom). Left and right columns are those of the pseudo-scalar and vector channels. The results are shown by orange bands, while the ground-state contribution (dot-dashed) and the ground-state and plus excited-state contribution (dashed) are plotted assuming that they have <inline-formula><tex-math notation="LaTeX" id="ImEquation305"><![CDATA[$\delta$]]></tex-math></inline-formula>-function structures.</p></caption>
<graphic xmlns:xlink="http://www.w3.org/1999/xlink" orientation="portrait" position="float" mimetype="image" xlink:href="ptaa044f9.tif"/></fig>
<p>When the smearing width is large, <inline-formula><tex-math notation="LaTeX" id="ImEquation306"><![CDATA[$\Delta=0.3$]]></tex-math></inline-formula> (bottom panels of <xref ref-type="fig" rid="F9">Fig. 9</xref>), we observe that the reconstructed smeared spectral function follows the expected form from the low-lying states in the lower region of <inline-formula><tex-math notation="LaTeX" id="ImEquation307"><![CDATA[$\omega$]]></tex-math></inline-formula>. As <inline-formula><tex-math notation="LaTeX" id="ImEquation308"><![CDATA[$\omega$]]></tex-math></inline-formula> increases, the spectral function indicates more contributions from higher excited states. This is exactly what we expected. The lattice data in the short time separations contain information on such states, which is properly extracted with our method. From perturbation theory, one expects a constant proportional to the number of color degrees of freedom <inline-formula><tex-math notation="LaTeX" id="ImEquation309"><![CDATA[$N_c=3$]]></tex-math></inline-formula> for the (unsmeared) spectral function <inline-formula><tex-math notation="LaTeX" id="ImEquation310"><![CDATA[$\rho(\omega)$]]></tex-math></inline-formula>. This constant is slightly distorted because of the difference between <inline-formula><tex-math notation="LaTeX" id="ImEquation311"><![CDATA[$\rho(\omega)$]]></tex-math></inline-formula> and <inline-formula><tex-math notation="LaTeX" id="ImEquation312"><![CDATA[$\bar{\rho}(\omega)$]]></tex-math></inline-formula>. For <inline-formula><tex-math notation="LaTeX" id="ImEquation313"><![CDATA[$t_0=1$]]></tex-math></inline-formula> (in the lattice unit), this should give an exponentially decreasing spectral function <inline-formula><tex-math notation="LaTeX" id="ImEquation314"><![CDATA[$\bar{\rho}_\Delta(\omega)$]]></tex-math></inline-formula> as <inline-formula><tex-math notation="LaTeX" id="ImEquation315"><![CDATA[$\sim \omega^2e^{-2\omega}$]]></tex-math></inline-formula> at large <inline-formula><tex-math notation="LaTeX" id="ImEquation316"><![CDATA[$\omega$]]></tex-math></inline-formula>, which is indeed observed in the results. On the other hand, the resonance structure is smeared out and invisible with <inline-formula><tex-math notation="LaTeX" id="ImEquation317"><![CDATA[$\Delta=0.3$]]></tex-math></inline-formula> as one can see from the contributions of the ground and first excited states.</p>
<p>For smaller smearing widths, <inline-formula><tex-math notation="LaTeX" id="ImEquation318"><![CDATA[$\Delta$]]></tex-math></inline-formula> = 0.2 and 0.1, a larger systematic error is expected due to the truncation of the Chebyshev approximation. For <inline-formula><tex-math notation="LaTeX" id="ImEquation319"><![CDATA[$\Delta=0.2$]]></tex-math></inline-formula>, a typical size of the error is about 10&#x2013;20% as one can see from Figs. <xref ref-type="fig" rid="F1">1</xref> and <xref ref-type="fig" rid="F2">2</xref>. (Dot-dashed lines correspond to <inline-formula><tex-math notation="LaTeX" id="ImEquation320"><![CDATA[$N=15$]]></tex-math></inline-formula>.) This error due to the truncation is not included in the band shown in <xref ref-type="fig" rid="F9">Fig. 9</xref>, but taking account of this marginal size of error the reconstructed <inline-formula><tex-math notation="LaTeX" id="ImEquation321"><![CDATA[$\rho_\Delta(\omega)$]]></tex-math></inline-formula> looks reasonable for <inline-formula><tex-math notation="LaTeX" id="ImEquation322"><![CDATA[$\Delta=0.2$]]></tex-math></inline-formula> (middle panels). Namely, it follows the expected curve of the ground and the first excited states up to around the peak of the latter and then drops slowly due to higher excited-state contributions.</p>
<p>The truncation error increases to 50&#x2013;100% for <inline-formula><tex-math notation="LaTeX" id="ImEquation323"><![CDATA[$\Delta=0.1$]]></tex-math></inline-formula> (upper panels of Figs. <xref ref-type="fig" rid="F1">1</xref> and <xref ref-type="fig" rid="F2">2</xref>), and we should not take the results (top panels of <xref ref-type="fig" rid="F9">Fig. 9</xref>) too seriously. If it were precisely calculated, we would be able to resolve the resonance structures as the curve of the low-lying state contributions suggests. To do so, we need to include higher-order terms of the Chebyshev approximation, which requires much better precision of the simulation data. This reflects the fact that the reconstruction of the full spectral function from Euclidean lattice data is an ill-posed problem. One needs ridiculously high precision in order to achieve a full reconstruction, as emphasized in Ref. [<xref ref-type="bibr" rid="B6">6</xref>].</p>
</sec>
<sec id="SEC5"><title>5. Discussions</title>
<p>As already mentioned earlier, our proposal to calculate the smeared spectral function is not limited to the case just discussed. Any sort of weighted integral of the spectral function can be considered. A well-known example is the contribution of quark vacuum polarization to the muon anomalous magnetic moment <inline-formula><tex-math notation="LaTeX" id="ImEquation324"><![CDATA[$g-2$]]></tex-math></inline-formula>. Phenomenologically, one employs the optical theorem and dispersion relation to relate the vacuum polarization function in the Euclidean domain <inline-formula><tex-math notation="LaTeX" id="ImEquation325"><![CDATA[$\Pi(Q^2)$]]></tex-math></inline-formula> to a weighted integral of the experimentally observed <inline-formula><tex-math notation="LaTeX" id="ImEquation326"><![CDATA[$R$]]></tex-math></inline-formula>-ratio, or the spectral function. Then, an integral of <inline-formula><tex-math notation="LaTeX" id="ImEquation327"><![CDATA[$\Pi(Q^2)$]]></tex-math></inline-formula> with an appropriate weight gives the contribution to <inline-formula><tex-math notation="LaTeX" id="ImEquation328"><![CDATA[$g-2$]]></tex-math></inline-formula>. In this case, however, a direct expression in terms of the time correlator <inline-formula><tex-math notation="LaTeX" id="ImEquation329"><![CDATA[$C(t)$]]></tex-math></inline-formula> is known [<xref ref-type="bibr" rid="B13">13</xref>], and we do not really need the approximation method developed in this work.</p>
<p>Another phenomenologically interesting example is the hadronic <inline-formula><tex-math notation="LaTeX" id="ImEquation330"><![CDATA[$\tau$]]></tex-math></inline-formula> decay. Using the finite-energy sum rule [<xref ref-type="bibr" rid="B22">22</xref>] the hadronic width can be written as
<disp-formula id="ptaa044M26"><label>(26)</label><tex-math notation="LaTeX" id="Equation26"><![CDATA[$$\begin{equation}
\label{eq:hadronic_tau}
R_\tau^{ud}=12\pi^2 S_{\rm EW}|V_{ud}|^2
\int_0^{m_\tau^2}\frac{ds}{m_\tau^2}
\left(1-\frac{s}{m_\tau^2}\right)^2
\left(1+\frac{2s}{m_\tau^2}\right)
\rho_{V+A}(s),
\end{equation}$$]]></tex-math></disp-formula>
where <inline-formula><tex-math notation="LaTeX" id="ImEquation331"><![CDATA[$S_{\rm EW}$]]></tex-math></inline-formula> is a short-distance electroweak correction and <inline-formula><tex-math notation="LaTeX" id="ImEquation332"><![CDATA[$|V_{ud}|$]]></tex-math></inline-formula> is a CKM matrix element. (Here, only the <inline-formula><tex-math notation="LaTeX" id="ImEquation333"><![CDATA[$ud$]]></tex-math></inline-formula> contribution is considered. An extension to the <inline-formula><tex-math notation="LaTeX" id="ImEquation334"><![CDATA[$us$]]></tex-math></inline-formula> contribution is straightforward.) The spectral function <inline-formula><tex-math notation="LaTeX" id="ImEquation335"><![CDATA[$\rho_{V+A}(s)$]]></tex-math></inline-formula> denotes a sum of <inline-formula><tex-math notation="LaTeX" id="ImEquation336"><![CDATA[$VV$]]></tex-math></inline-formula> and <inline-formula><tex-math notation="LaTeX" id="ImEquation337"><![CDATA[$AA$]]></tex-math></inline-formula> channels. The integral (<xref ref-type="disp-formula" rid="ptaa044M26">26</xref>) reflects a particular kinematics of <inline-formula><tex-math notation="LaTeX" id="ImEquation338"><![CDATA[$\tau$]]></tex-math></inline-formula> decay and has a complicated form, but our method can be applied for such a case in principle. A practical question would be, however, whether a good enough approximation can be achieved with a limited number of terms.</p>
<p>The Laplace transform (<xref ref-type="disp-formula" rid="ptaa044M23">23</xref>) is often considered in QCD sum rule analyses [<xref ref-type="bibr" rid="B11">11</xref>] because the corresponding Borel transform of perturbative series makes it more convergent. Our method allows calculation of the two-point function after the Borel transform directly using lattice QCD. It may be useful to test the perturbative expansion and the operator product expansion involved in the QCD sum rule calculations. Conversely, it can also be used to validate lattice QCD calculations, especially in the short-distance region. Such a test has been performed using short-distance correlators in the coordinate space [<xref ref-type="bibr" rid="B17">17</xref>], and it is interesting to do the test for the Borel-transformed quantities.</p>
<p>The dispersion integral of the form (<xref ref-type="disp-formula" rid="ptaa044M2">2</xref>) is of course another type of application of our method. Although the vacuum polarization function <inline-formula><tex-math notation="LaTeX" id="ImEquation339"><![CDATA[$\Pi(Q^2)$]]></tex-math></inline-formula> in the space-like momenta <inline-formula><tex-math notation="LaTeX" id="ImEquation340"><![CDATA[$Q^2$]]></tex-math></inline-formula> can be directly obtained by a Fourier transform of the lattice correlators, the Chebyshev approximation offers a method to extract it at arbitrary values of <inline-formula><tex-math notation="LaTeX" id="ImEquation341"><![CDATA[$Q^2$]]></tex-math></inline-formula> corresponding to the momenta of non-integer multiples of <inline-formula><tex-math notation="LaTeX" id="ImEquation342"><![CDATA[$2\pi/L$]]></tex-math></inline-formula>. The Laplace transform as introduced in Ref. [<xref ref-type="bibr" rid="B23">23</xref>] can do this too, but requires information on large time separations in the integral of the form <inline-formula><tex-math notation="LaTeX" id="ImEquation343"><![CDATA[$\int_0^\infty dt\,e^{\omega t}C(t)$]]></tex-math></inline-formula>. The method developed in this work accesses only relatively short time separations, but we need to introduce an approximation. The systematic error in each case has to be carefully examined.</p>
<p>Extension to the cases of more complicated quantities, such as the nucleon structure function as measured in deep inelastic scattering or the inclusive hadron decays, can also be considered. One of the authors has proposed an analysis to use the dispersion integral to relate the inclusive decay rate to an amplitude in space-like momenta [<xref ref-type="bibr" rid="B24">24</xref>]. This method contains a difficulty of requiring the information in unphysical momentum regions, which may be avoided by the more flexible integral transformation proposed in this work.</p>
<p>For this class of applications, there are two independent kinematical variables, <inline-formula><tex-math notation="LaTeX" id="ImEquation344"><![CDATA[$q^2$]]></tex-math></inline-formula> and <inline-formula><tex-math notation="LaTeX" id="ImEquation345"><![CDATA[$p\cdot q$]]></tex-math></inline-formula>, with <inline-formula><tex-math notation="LaTeX" id="ImEquation346"><![CDATA[$p$]]></tex-math></inline-formula> the momentum of a decaying particle (or the initial nucleon) and <inline-formula><tex-math notation="LaTeX" id="ImEquation347"><![CDATA[$q$]]></tex-math></inline-formula> the momentum transfer. In order to apply the method outlined in this work, we need to fix one of these kinematical variables and introduce a smearing on the other variable. A more complicated integral might be useful for <inline-formula><tex-math notation="LaTeX" id="ImEquation348"><![CDATA[$b\to u\ell\nu$]]></tex-math></inline-formula> decay analysis, for which one introduces elaborate kinematical cuts in order to avoid backgrounds from <inline-formula><tex-math notation="LaTeX" id="ImEquation349"><![CDATA[$b\to c\ell\nu$]]></tex-math></inline-formula>. The flexibility of our method would allow such analyses.</p>
<p>In fact, such analysis is formulated in a slightly different form in Ref. [<xref ref-type="bibr" rid="B25">25</xref>]. The key is to select the final states of a given energy, and some smearing of the energy is introduced to make it practical. An interesting point is that one can identify the smearing function as obtained from the <inline-formula><tex-math notation="LaTeX" id="ImEquation350"><![CDATA[$i\epsilon$]]></tex-math></inline-formula> prescription <inline-formula><tex-math notation="LaTeX" id="ImEquation351"><![CDATA[$i/(\omega-\omega'+i\epsilon)$]]></tex-math></inline-formula>, which naturally appears from the LSZ reduction formula. It then allows us to extract both the real and imaginary parts of the relevant amplitudes.</p>
<p>Going to high-temperature QCD, our method would not work as it is, because the correlator cannot be simply written as <inline-formula><tex-math notation="LaTeX" id="ImEquation352"><![CDATA[$\langle\psi|\hat{z}^t|\psi\rangle$]]></tex-math></inline-formula> due to the contribution from the opposite time direction. The operator is then no longer a power of the transfer matrix, so direct estimate of the Chebyshev matrix elements is not available.</p>
</sec>
<sec id="SEC6"><title>6. Conclusions</title>
<p>Precise reconstruction of the spectral function from lattice data remains a difficult problem. Instead, we calculate a smeared counterpart, which contains some information on the spectral function after smearing out its detailed structures. For the charmonium spectral function we obtain a reasonably precise result for a smearing width <inline-formula><tex-math notation="LaTeX" id="ImEquation353"><![CDATA[$\Delta$]]></tex-math></inline-formula> = 0.3, which is about 700 MeV in physical units. Since the mass splittings experimentally observed are narrower than this, we are not able to resolve the details of the spectrum. Taking the limit of small smearing width requires exponentially better statistical precision, and it comes back to the original problem. Still, our proposal has advantages compared to previously available methods.</p>
<p>In contrast to the Bayesian approach [<xref ref-type="bibr" rid="B3">3</xref>] or the maximum entropy method [<xref ref-type="bibr" rid="B1">1</xref>,<xref ref-type="bibr" rid="B2">2</xref>], our method allows a reliable estimate of the systematic errors, since it does not assume any statistical distribution of an unknown function. In principle, the method is deterministic once the input lattice data are given. The least-squares fit involved in order to enforce the constraint that eigenvalues of the Hamiltonian are positive plays only a minor role that becomes irrelevant when the lattice data are made precise.</p>
<p>Compared to the Backus&#x2013;Gilbert method [<xref ref-type="bibr" rid="B5">5</xref>], the method proposed in this paper is more flexible as it allows any predefined smearing function, while it is automatically determined in the Backus&#x2013;Gilbert method and therefore is uncontrollable. The variant of the Backus&#x2013;Gilbert method [<xref ref-type="bibr" rid="B6">6</xref>] also has this flexibility. Our method also allows systematic improvements since the approximation is achieved by a series of exponentially decreasing coefficients. As the statistical precision of the input correlator is improved, one can include higher-order terms and thus improve the approximation.</p>
<p>The method can be used in the analysis of inclusive processes to define intermediate quantities for which fully non-perturbative lattice calculation is possible. Its potential application is not limited to the spectral function for two-point correlators; other processes such as deep inelastic scattering and inclusive <inline-formula><tex-math notation="LaTeX" id="ImEquation354"><![CDATA[$B$]]></tex-math></inline-formula> meson decays can be considered. Since the method does not rely on perturbation theory, processes with small momentum transfer can be calculated on solid theoretical ground, which has not been available up to now. More importantly, we do not have to rely on the assumption of quark&#x2013;hadron duality.</p>
</sec>
</body>
<back>
<ack id="ack1">
<title>Acknowledgements</title>
<p>We thank the members of the JLQCD Collaboration for discussions and for providing the computational framework and lattice data. Numerical calculations are performed on the Oakforest-PACS supercomputer operated by the Joint Center for Advanced High Performance Computing (JCAHPC), as well as on the SX-Aurora TSUBASA at KEK used under its &#x201C;Particle, Nuclear, and Astro Physics Simulation Program&#x201D;. This work is supported in part by JSPS KAKENHI Grant Number 18H03710 and by the Post-K supercomputer project through the Joint Institute for Computational Fundamental Science (JICFuS).</p>
</ack>
<sec><title>Funding</title>
<p>Open Access funding: SCOAP<inline-formula><tex-math notation="LaTeX" id="ImEquation355"><![CDATA[$^{3}$]]></tex-math></inline-formula>.</p>
</sec>
<fn-group>
<title>Footnotes</title>
<fn id="FN1"><p><sup>1</sup> In practice, one needs to use the subtracted version to avoid ultraviolet divergences.</p></fn>
<fn id="FN2"><p><sup>2</sup> One should also notice that the argument for <inline-formula><tex-math notation="LaTeX" id="ImEquation356"><![CDATA[$\bar{\rho}(\omega)$]]></tex-math></inline-formula> is an energy <inline-formula><tex-math notation="LaTeX" id="ImEquation357"><![CDATA[$\omega$]]></tex-math></inline-formula>, while that for <inline-formula><tex-math notation="LaTeX" id="ImEquation358"><![CDATA[$\rho(p^2)$]]></tex-math></inline-formula> is energy squared.</p></fn>
<fn id="FN3"><p><sup>3</sup> It is also different from the definition in Eq. (<xref ref-type="disp-formula" rid="ptaa044M8">8</xref>) by a factor of <inline-formula><tex-math notation="LaTeX" id="ImEquation359"><![CDATA[$\omega^2$]]></tex-math></inline-formula> because the factor due to the polarization tensor <inline-formula><tex-math notation="LaTeX" id="ImEquation360"><![CDATA[$(q_\mu q_\nu-q^2\delta_{\mu\nu})$]]></tex-math></inline-formula> is taken out.</p></fn>
</fn-group>
<ref-list id="ref1">
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