From ad01b915d0098550c6e57b03168d61ca32deb3ab Mon Sep 17 00:00:00 2001 From: FanwangM Date: Thu, 3 Oct 2024 03:57:19 +0000 Subject: [PATCH] deploy: c625af7461b9f1ed453205cf12075b16d4137f51 --- .buildinfo | 2 +- _autosummary/atomdb.datasets.gaussian.html | 93 ++++++++-------- _autosummary/atomdb.datasets.hci.html | 93 ++++++++-------- _autosummary/atomdb.datasets.html | 93 ++++++++-------- _autosummary/atomdb.datasets.nist.html | 93 ++++++++-------- _autosummary/atomdb.datasets.numeric.html | 93 ++++++++-------- _autosummary/atomdb.datasets.slater.html | 93 ++++++++-------- .../atomdb.datasets.uhf_augccpvdz.html | 93 ++++++++-------- _autosummary/atomdb.html | 93 ++++++++-------- _autosummary/modules.html | 91 +++++++-------- _sources/installation.rst | 7 +- _sphinx_design_static/design-tabs.js | 104 +++++++++++++++--- ...8e8ffc24.min.css => sphinx-design.min.css} | 2 +- _static/design-tabs.js | 104 +++++++++++++++--- _static/locales/ar/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/bg/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/bn/LC_MESSAGES/booktheme.po | 54 ++++----- _static/locales/ca/LC_MESSAGES/booktheme.po | 54 ++++----- _static/locales/cs/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/da/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/de/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/el/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/eo/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/es/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/et/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/fi/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/fr/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/hr/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/id/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/it/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/iw/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/ja/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/ko/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/lt/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/lv/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/ml/LC_MESSAGES/booktheme.po | 54 ++++----- _static/locales/mr/LC_MESSAGES/booktheme.po | 54 ++++----- _static/locales/ms/LC_MESSAGES/booktheme.po | 54 ++++----- _static/locales/nl/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/no/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/pl/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/pt/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/ro/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/ru/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/sk/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/sl/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/sr/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/sv/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/ta/LC_MESSAGES/booktheme.po | 54 ++++----- _static/locales/te/LC_MESSAGES/booktheme.po | 54 ++++----- _static/locales/tg/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/th/LC_MESSAGES/booktheme.po | 60 +++++----- _static/locales/tl/LC_MESSAGES/booktheme.po | 54 ++++----- _static/locales/tr/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/uk/LC_MESSAGES/booktheme.po | 64 +++++------ _static/locales/ur/LC_MESSAGES/booktheme.po | 54 ++++----- _static/locales/vi/LC_MESSAGES/booktheme.po | 64 +++++------ .../locales/zh_CN/LC_MESSAGES/booktheme.po | 60 +++++----- .../locales/zh_TW/LC_MESSAGES/booktheme.po | 64 +++++------ _static/scripts/bootstrap.js | 2 +- _static/scripts/bootstrap.js.LICENSE.txt | 4 +- _static/scripts/bootstrap.js.map | 2 +- _static/scripts/pydata-sphinx-theme.js | 2 +- _static/scripts/pydata-sphinx-theme.js.map | 2 +- _static/scripts/sphinx-book-theme.js | 2 +- _static/scripts/sphinx-book-theme.js.map | 2 +- _static/searchtools.js | 7 +- ...8e8ffc24.min.css => sphinx-design.min.css} | 2 +- _static/styles/bootstrap.css | 6 +- _static/styles/bootstrap.css.map | 2 +- _static/styles/pydata-sphinx-theme.css | 2 +- _static/styles/pydata-sphinx-theme.css.map | 2 +- _static/styles/sphinx-book-theme.css | 3 +- _static/styles/sphinx-book-theme.css.map | 1 + .../vendor/fontawesome/6.5.1/css/all.min.css | 5 - .../vendor/fontawesome/6.5.1/js/all.min.js | 2 - .../6.5.1/webfonts/fa-brands-400.woff2 | Bin 117372 -> 0 bytes .../6.5.1/webfonts/fa-regular-400.woff2 | Bin 25452 -> 0 bytes .../6.5.1/webfonts/fa-solid-900.woff2 | Bin 156496 -> 0 bytes .../6.5.1/webfonts/fa-v4compatibility.woff2 | Bin 4792 -> 0 bytes .../fontawesome/{6.5.1 => 6.5.2}/LICENSE.txt | 4 +- .../vendor/fontawesome/6.5.2/css/all.min.css | 5 + .../vendor/fontawesome/6.5.2/js/all.min.js | 2 + .../js/all.min.js.LICENSE.txt | 4 +- .../webfonts/fa-brands-400.ttf | Bin 207972 -> 209128 bytes .../6.5.2/webfonts/fa-brands-400.woff2 | Bin 0 -> 117852 bytes .../webfonts/fa-regular-400.ttf | Bin 68004 -> 67860 bytes .../6.5.2/webfonts/fa-regular-400.woff2 | Bin 0 -> 25392 bytes .../webfonts/fa-solid-900.ttf | Bin 419720 -> 420332 bytes .../6.5.2/webfonts/fa-solid-900.woff2 | Bin 0 -> 156400 bytes .../webfonts/fa-v4compatibility.ttf | Bin 10832 -> 10832 bytes .../6.5.2/webfonts/fa-v4compatibility.woff2 | Bin 0 -> 4792 bytes _static/webpack-macros.html | 24 ++-- api/index.html | 96 ++++++++-------- api/notebooks/getting_started.html | 97 ++++++++-------- api/notebooks/hello_atomdb.html | 97 ++++++++-------- api/notebooks/promolecule_intro.html | 97 ++++++++-------- api/notebooks/promolecule_nci.html | 97 ++++++++-------- examples/getting_started.html | 97 ++++++++-------- examples/hello_atomdb.html | 97 ++++++++-------- examples/promolecule_intro.html | 97 ++++++++-------- examples/promolecule_nci.html | 97 ++++++++-------- genindex.html | 91 +++++++-------- installation.html | 99 +++++++++-------- objects.inv | Bin 1537 -> 1551 bytes py-modindex.html | 91 +++++++-------- search.html | 91 +++++++-------- searchindex.js | 2 +- 108 files changed, 2695 insertions(+), 2474 deletions(-) rename _sphinx_design_static/{design-style.1e8bd061cd6da7fc9cf755528e8ffc24.min.css => sphinx-design.min.css} (87%) rename _static/{design-style.1e8bd061cd6da7fc9cf755528e8ffc24.min.css => sphinx-design.min.css} (87%) create mode 100644 _static/styles/sphinx-book-theme.css.map delete mode 100644 _static/vendor/fontawesome/6.5.1/css/all.min.css delete mode 100644 _static/vendor/fontawesome/6.5.1/js/all.min.js delete mode 100644 _static/vendor/fontawesome/6.5.1/webfonts/fa-brands-400.woff2 delete mode 100644 _static/vendor/fontawesome/6.5.1/webfonts/fa-regular-400.woff2 delete mode 100644 _static/vendor/fontawesome/6.5.1/webfonts/fa-solid-900.woff2 delete mode 100644 _static/vendor/fontawesome/6.5.1/webfonts/fa-v4compatibility.woff2 rename _static/vendor/fontawesome/{6.5.1 => 6.5.2}/LICENSE.txt (98%) create mode 100644 _static/vendor/fontawesome/6.5.2/css/all.min.css create mode 100644 _static/vendor/fontawesome/6.5.2/js/all.min.js rename _static/vendor/fontawesome/{6.5.1 => 6.5.2}/js/all.min.js.LICENSE.txt (55%) rename _static/vendor/fontawesome/{6.5.1 => 6.5.2}/webfonts/fa-brands-400.ttf (92%) create mode 100644 _static/vendor/fontawesome/6.5.2/webfonts/fa-brands-400.woff2 rename _static/vendor/fontawesome/{6.5.1 => 6.5.2}/webfonts/fa-regular-400.ttf (95%) create mode 100644 _static/vendor/fontawesome/6.5.2/webfonts/fa-regular-400.woff2 rename _static/vendor/fontawesome/{6.5.1 => 6.5.2}/webfonts/fa-solid-900.ttf (93%) create mode 100644 _static/vendor/fontawesome/6.5.2/webfonts/fa-solid-900.woff2 rename _static/vendor/fontawesome/{6.5.1 => 6.5.2}/webfonts/fa-v4compatibility.ttf (86%) create mode 100644 _static/vendor/fontawesome/6.5.2/webfonts/fa-v4compatibility.woff2 diff --git a/.buildinfo b/.buildinfo index 0e6ffeaf..07b7f77a 100644 --- a/.buildinfo +++ b/.buildinfo @@ -1,4 +1,4 @@ # Sphinx build info version 1 # This file hashes the configuration used when building these files. When it is not found, a full rebuild will be done. -config: a53b13127aeaee5e88934bf19384f07c +config: a510e8042657d72dc47a1a5e99fdb367 tags: 645f666f9bcd5a90fca523b33c5a78b7 diff --git a/_autosummary/atomdb.datasets.gaussian.html b/_autosummary/atomdb.datasets.gaussian.html index f030b994..e4b4f54d 100644 --- a/_autosummary/atomdb.datasets.gaussian.html +++ b/_autosummary/atomdb.datasets.gaussian.html @@ -14,45 +14,45 @@ - - - + + + - - - - + + + + - + - + - - - + + + - + - + @@ -72,27 +72,23 @@ - +
+ Back to top - + id="pst-primary-sidebar-checkbox"/> + - + id="pst-secondary-sidebar-checkbox"/> +
@@ -114,8 +110,13 @@ Ctrl+K
+ +
+ +
+ -
+
@@ -139,6 +140,8 @@
+ +

+