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2 changes: 1 addition & 1 deletion docs/_static/documentation_options.js
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VERSION: '2022.4.19',
VERSION: '2022.4.26',
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COLLAPSE_INDEX: false,
BUILDER: 'html',
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4 changes: 2 additions & 2 deletions docs/addons.html
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<meta charset="utf-8" /><meta name="generator" content="Docutils 0.17.1: http://docutils.sourceforge.net/" />

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<title>Pymatgen Add-ons &mdash; pymatgen 2022.4.19 documentation</title>
<title>Pymatgen Add-ons &mdash; pymatgen 2022.4.26 documentation</title>
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<a href="index.html" class="icon icon-home"> pymatgen
</a>
<div class="version">
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2022.4.26
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14 changes: 12 additions & 2 deletions docs/change_log.html
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<meta charset="utf-8" /><meta name="generator" content="Docutils 0.17.1: http://docutils.sourceforge.net/" />

<meta name="viewport" content="width=device-width, initial-scale=1.0" />
<title>Change log &mdash; pymatgen 2022.4.19 documentation</title>
<title>Change log &mdash; pymatgen 2022.4.26 documentation</title>
<link rel="stylesheet" href="_static/pygments.css" type="text/css" />
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<a href="index.html" class="icon icon-home"> pymatgen
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<div class="version">
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2022.4.26
</div>
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<li class="toctree-l1"><a class="reference internal" href="introduction.html">Introduction</a></li>
<li class="toctree-l1"><a class="reference internal" href="installation.html">Installation</a></li>
<li class="toctree-l1 current"><a class="current reference internal" href="#">Change log</a><ul>
<li class="toctree-l2"><a class="reference internal" href="#v2022-4-26">v2022.4.26</a></li>
<li class="toctree-l2"><a class="reference internal" href="#v2022-4-19">v2022.4.19</a></li>
<li class="toctree-l2"><a class="reference internal" href="#v2022-3-29">v2022.3.29</a></li>
<li class="toctree-l2"><a class="reference internal" href="#v2022-3-24">v2022.3.24</a></li>
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<section id="change-log">
<h1>Change log<a class="headerlink" href="#change-log" title="Permalink to this headline"></a></h1>
<section id="v2022-4-26">
<h2>v2022.4.26<a class="headerlink" href="#v2022-4-26" title="Permalink to this headline"></a></h2>
<ul class="simple">
<li><p>Fix dipole units in recent vasp versions (at least 6.3, maybe even before) (&#64;&#64;fraricci)</p></li>
<li><p>Removed complex numbers from the definition of WSWQ (&#64;jmmshn)</p></li>
<li><p>MP database version logging is now no longer logged in the .pmgrc.yaml but rather in the .mprester.log.yaml.
This avoids the MPRester constantly rewriting a config file and causing users’ pymatgen to completely fail.</p></li>
</ul>
</section>
<section id="v2022-4-19">
<h2>v2022.4.19<a class="headerlink" href="#v2022-4-19" title="Permalink to this headline"></a></h2>
<ul class="simple">
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4 changes: 2 additions & 2 deletions docs/compatibility.html
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<meta charset="utf-8" /><meta name="generator" content="Docutils 0.17.1: http://docutils.sourceforge.net/" />

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<title>Compatibility &mdash; pymatgen 2022.4.19 documentation</title>
<title>Compatibility &mdash; pymatgen 2022.4.26 documentation</title>
<link rel="stylesheet" href="_static/pygments.css" type="text/css" />
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<a href="index.html" class="icon icon-home"> pymatgen
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<div class="version">
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4 changes: 2 additions & 2 deletions docs/contributing.html
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<meta charset="utf-8" /><meta name="generator" content="Docutils 0.17.1: http://docutils.sourceforge.net/" />

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<a href="index.html" class="icon icon-home"> pymatgen
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<div class="version">
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<head>
<meta charset="utf-8" />
<meta name="viewport" content="width=device-width, initial-scale=1.0" />
<title>Index &mdash; pymatgen 2022.4.19 documentation</title>
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<a href="index.html" class="icon icon-home"> pymatgen
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<div class="version">
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Expand Down Expand Up @@ -2319,8 +2319,6 @@ <h2 id="D">D</h2>
<li><a href="pymatgen.io.wannier90.html#id0">(Unk property)</a>
</li>
<li><a href="pymatgen.io.vasp.outputs.html#pymatgen.io.vasp.outputs.Wavederf.data">(Wavederf attribute)</a>
</li>
<li><a href="pymatgen.io.vasp.outputs.html#pymatgen.io.vasp.outputs.WSWQ.data">(WSWQ attribute)</a>
</li>
</ul></li>
<li><a href="pymatgen.io.abinit.variable.html#pymatgen.io.abinit.variable.InputVariable.dataset">dataset (InputVariable property)</a>
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<li><a href="pymatgen.io.lammps.inputs.html#pymatgen.io.lammps.inputs.LammpsRun.md">md() (LammpsRun class method)</a>
</li>
<li><a href="pymatgen.io.abinit.pseudos.html#pymatgen.io.abinit.pseudos.Pseudo.md5">md5() (Pseudo method)</a>
</li>
<li><a href="pymatgen.io.vasp.outputs.html#id0">me_imag (WSWQ attribute)</a>, <a href="pymatgen.io.vasp.outputs.html#pymatgen.io.vasp.outputs.WSWQ.me_imag">[1]</a>
</li>
<li><a href="pymatgen.io.vasp.outputs.html#id1">me_real (WSWQ attribute)</a>, <a href="pymatgen.io.vasp.outputs.html#pymatgen.io.vasp.outputs.WSWQ.me_real">[1]</a>
</li>
<li><a href="pymatgen.analysis.chemenv.utils.func_utils.html#pymatgen.analysis.chemenv.utils.func_utils.CSMFiniteRatioFunction.mean_estimator">mean_estimator() (CSMFiniteRatioFunction method)</a>

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<ul>
<li><a href="pymatgen.io.vasp.outputs.html#pymatgen.io.vasp.outputs.Waveder.nbands">(Waveder property)</a>
</li>
<li><a href="pymatgen.io.vasp.outputs.html#pymatgen.io.vasp.outputs.WSWQ.nbands">(WSWQ attribute)</a>
<li><a href="pymatgen.io.vasp.outputs.html#id2">(WSWQ attribute)</a>, <a href="pymatgen.io.vasp.outputs.html#pymatgen.io.vasp.outputs.WSWQ.nbands">[1]</a>
</li>
</ul></li>
<li><a href="pymatgen.io.wannier90.html#id3">nbnd (Unk attribute)</a>, <a href="pymatgen.io.wannier90.html#pymatgen.io.wannier90.Unk.nbnd">[1]</a>
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<li><a href="pymatgen.io.vasp.outputs.html#pymatgen.io.vasp.outputs.Waveder.nkpoints">nkpoints (Waveder property)</a>

<ul>
<li><a href="pymatgen.io.vasp.outputs.html#pymatgen.io.vasp.outputs.WSWQ.nkpoints">(WSWQ attribute)</a>
<li><a href="pymatgen.io.vasp.outputs.html#id3">(WSWQ attribute)</a>, <a href="pymatgen.io.vasp.outputs.html#pymatgen.io.vasp.outputs.WSWQ.nkpoints">[1]</a>
</li>
</ul></li>
</ul></td>
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</li>
<li><a href="pymatgen.io.vasp.outputs.html#pymatgen.io.vasp.outputs.Dynmat.nspecs">nspecs (Dynmat property)</a>
</li>
<li><a href="pymatgen.io.vasp.outputs.html#pymatgen.io.vasp.outputs.WSWQ.nspin">nspin (WSWQ attribute)</a>
<li><a href="pymatgen.io.vasp.outputs.html#id4">nspin (WSWQ attribute)</a>, <a href="pymatgen.io.vasp.outputs.html#pymatgen.io.vasp.outputs.WSWQ.nspin">[1]</a>
</li>
<li><a href="pymatgen.io.abinit.abiobjects.html#pymatgen.io.abinit.abiobjects.Electrons.nspinor">nspinor (Electrons property)</a>
</li>
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<meta charset="utf-8" /><meta name="generator" content="Docutils 0.17.1: http://docutils.sourceforge.net/" />

<meta name="viewport" content="width=device-width, initial-scale=1.0" />
<title>Introduction &mdash; pymatgen 2022.4.19 documentation</title>
<title>Introduction &mdash; pymatgen 2022.4.26 documentation</title>
<link rel="stylesheet" href="_static/pygments.css" type="text/css" />
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<a href="#" class="icon icon-home"> pymatgen
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<div class="version">
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</div>
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Expand Down Expand Up @@ -207,14 +207,13 @@ <h2>Why use pymatgen?<a class="headerlink" href="#why-use-pymatgen" title="Perma
</section>
<section id="change-log">
<h2>Change log<a class="headerlink" href="#change-log" title="Permalink to this headline"></a></h2>
<section id="v2022-4-19">
<h3>v2022.4.19<a class="headerlink" href="#v2022-4-19" title="Permalink to this headline"></a></h3>
<section id="v2022-4-26">
<h3>v2022.4.26<a class="headerlink" href="#v2022-4-26" title="Permalink to this headline"></a></h3>
<ul class="simple">
<li><p>Fix for discharged and charged entries in conversion battery. (&#64;peikai)`pylint` in <cite>.pre-commit-config.yaml</cite>.</p></li>
<li><p>Allow skipping of structure reduction in StructureMatcher.group_structures (&#64;lan496)</p></li>
<li><p>Return NotImplemented for composition comparison methods. (&#64;janosh)</p></li>
<li><p>BSPlotter bug fixes (&#64;fraricci)</p></li>
<li><p>Misc bug fixes and deprecation fixes.</p></li>
<li><p>Fix dipole units in recent vasp versions (at least 6.3, maybe even before) (&#64;&#64;fraricci)</p></li>
<li><p>Removed complex numbers from the definition of WSWQ (&#64;jmmshn)</p></li>
<li><p>MP database version logging is now no longer logged in the .pmgrc.yaml but rather in the .mprester.log.yaml.
This avoids the MPRester constantly rewriting a config file and causing users’ pymatgen to completely fail.</p></li>
</ul>
<p><a class="reference internal" href="change_log.html"><span class="doc">Older versions</span></a></p>
</section>
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<meta charset="utf-8" /><meta name="generator" content="Docutils 0.17.1: http://docutils.sourceforge.net/" />

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<a href="index.html" class="icon icon-home"> pymatgen
</a>
<div class="version">
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</div>
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19 changes: 9 additions & 10 deletions docs/introduction.html
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<meta charset="utf-8" /><meta name="generator" content="Docutils 0.17.1: http://docutils.sourceforge.net/" />

<meta name="viewport" content="width=device-width, initial-scale=1.0" />
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<title>Introduction &mdash; pymatgen 2022.4.26 documentation</title>
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</a>
<div class="version">
2022.4.19
2022.4.26
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Expand All @@ -55,7 +55,7 @@
<li class="toctree-l2"><a class="reference internal" href="#matgenie-examples">Matgenie &amp; Examples</a></li>
<li class="toctree-l2"><a class="reference internal" href="#why-use-pymatgen">Why use pymatgen?</a></li>
<li class="toctree-l2"><a class="reference internal" href="#change-log">Change log</a><ul>
<li class="toctree-l3"><a class="reference internal" href="#v2022-4-19">v2022.4.19</a></li>
<li class="toctree-l3"><a class="reference internal" href="#v2022-4-26">v2022.4.26</a></li>
</ul>
</li>
<li class="toctree-l2"><a class="reference internal" href="#getting-pymatgen">Getting pymatgen</a></li>
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</section>
<section id="change-log">
<h2>Change log<a class="headerlink" href="#change-log" title="Permalink to this headline"></a></h2>
<section id="v2022-4-19">
<h3>v2022.4.19<a class="headerlink" href="#v2022-4-19" title="Permalink to this headline"></a></h3>
<section id="v2022-4-26">
<h3>v2022.4.26<a class="headerlink" href="#v2022-4-26" title="Permalink to this headline"></a></h3>
<ul class="simple">
<li><p>Fix for discharged and charged entries in conversion battery. (&#64;peikai)`pylint` in <cite>.pre-commit-config.yaml</cite>.</p></li>
<li><p>Allow skipping of structure reduction in StructureMatcher.group_structures (&#64;lan496)</p></li>
<li><p>Return NotImplemented for composition comparison methods. (&#64;janosh)</p></li>
<li><p>BSPlotter bug fixes (&#64;fraricci)</p></li>
<li><p>Misc bug fixes and deprecation fixes.</p></li>
<li><p>Fix dipole units in recent vasp versions (at least 6.3, maybe even before) (&#64;&#64;fraricci)</p></li>
<li><p>Removed complex numbers from the definition of WSWQ (&#64;jmmshn)</p></li>
<li><p>MP database version logging is now no longer logged in the .pmgrc.yaml but rather in the .mprester.log.yaml.
This avoids the MPRester constantly rewriting a config file and causing users’ pymatgen to completely fail.</p></li>
</ul>
<p><a class="reference internal" href="change_log.html"><span class="doc">Older versions</span></a></p>
</section>
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<meta charset="utf-8" /><meta name="generator" content="Docutils 0.17.1: http://docutils.sourceforge.net/" />

<meta name="viewport" content="width=device-width, initial-scale=1.0" />
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<title>Change log &mdash; pymatgen 2022.4.26 documentation</title>
<link rel="stylesheet" href="_static/pygments.css" type="text/css" />
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<div class="version">
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2022.4.26
</div>
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Expand Down Expand Up @@ -85,14 +85,13 @@

<section id="change-log">
<h1>Change log<a class="headerlink" href="#change-log" title="Permalink to this headline"></a></h1>
<section id="v2022-4-19">
<h2>v2022.4.19<a class="headerlink" href="#v2022-4-19" title="Permalink to this headline"></a></h2>
<section id="v2022-4-26">
<h2>v2022.4.26<a class="headerlink" href="#v2022-4-26" title="Permalink to this headline"></a></h2>
<ul class="simple">
<li><p>Fix for discharged and charged entries in conversion battery. (&#64;peikai)`pylint` in <cite>.pre-commit-config.yaml</cite>.</p></li>
<li><p>Allow skipping of structure reduction in StructureMatcher.group_structures (&#64;lan496)</p></li>
<li><p>Return NotImplemented for composition comparison methods. (&#64;janosh)</p></li>
<li><p>BSPlotter bug fixes (&#64;fraricci)</p></li>
<li><p>Misc bug fixes and deprecation fixes.</p></li>
<li><p>Fix dipole units in recent vasp versions (at least 6.3, maybe even before) (&#64;&#64;fraricci)</p></li>
<li><p>Removed complex numbers from the definition of WSWQ (&#64;jmmshn)</p></li>
<li><p>MP database version logging is now no longer logged in the .pmgrc.yaml but rather in the .mprester.log.yaml.
This avoids the MPRester constantly rewriting a config file and causing users’ pymatgen to completely fail.</p></li>
</ul>
</section>
</section>
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<meta charset="utf-8" /><meta name="generator" content="Docutils 0.17.1: http://docutils.sourceforge.net/" />

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<head>
<meta charset="utf-8" />
<meta name="viewport" content="width=device-width, initial-scale=1.0" />
<title>Python Module Index &mdash; pymatgen 2022.4.19 documentation</title>
<title>Python Module Index &mdash; pymatgen 2022.4.26 documentation</title>
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