diff --git a/.buildinfo b/.buildinfo index 4bcf6c49..2c9a8023 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: d67ae7397bd4b3f511ea1065ba67c286 +config: d51c0e48c433b18a043a7a88d09f6c47 tags: 645f666f9bcd5a90fca523b33c5a78b7 diff --git a/.doctrees/changelog.doctree b/.doctrees/changelog.doctree index 313785e0..1e51e620 100644 Binary files a/.doctrees/changelog.doctree and b/.doctrees/changelog.doctree differ diff --git a/.doctrees/environment.pickle b/.doctrees/environment.pickle index 808185ad..872b4b0b 100644 Binary files a/.doctrees/environment.pickle and b/.doctrees/environment.pickle differ diff --git a/.doctrees/install.doctree b/.doctrees/install.doctree index fe5639c2..e6f7f336 100644 Binary files a/.doctrees/install.doctree and b/.doctrees/install.doctree differ diff --git a/README.html b/README.html index ba77dd22..77f9395a 100644 --- a/README.html +++ b/README.html @@ -8,7 +8,7 @@ - How to write phono3py documentation — Phono3py v.3.3.0 + How to write phono3py documentation — Phono3py v.3.3.2 @@ -36,7 +36,7 @@ - + @@ -132,7 +132,7 @@ -

Phono3py v.3.3.0

+

Phono3py v.3.3.2

@@ -415,6 +415,10 @@

How to publish +

+By Author name not set +

+

diff --git a/_sources/changelog.md b/_sources/changelog.md index 77c32354..480a9b91 100644 --- a/_sources/changelog.md +++ b/_sources/changelog.md @@ -2,6 +2,15 @@ # Change Log +## Jul-22-2024: Version 3.3.2 + +- Minor fix of `phono3py.load` function for reading displacements from + `phono3py_disp.yaml` like file that doesn't contain forces. + +## Jul-8-2024: Version 3.3.1 + +- Major refactoring to isolate reciprocal space grid code. + ## Jul-8-2024: Version 3.3.0 - Build system of phono3py was renewed. Now nanobind, cmake, and diff --git a/_sources/install.md b/_sources/install.md index f3103668..04a10c1f 100644 --- a/_sources/install.md +++ b/_sources/install.md @@ -136,12 +136,13 @@ wrong python libraries can be imported. % cd phonopy % pip install -e . -vvv % cd ../phono3py - % pip install -e . -vvv + % pip install . -vvv ``` - The conda packages dependency can often change and this recipe may not work - properly. So if you find this instruction doesn't work, it is very - appreciated if letting us know it in the phonopy mailing list. + The editable install (`pip install -e`) may not work depending on the + computer environment. The conda packages dependency can often change and this + recipe may not work properly. So if you find this instruction doesn't work, + it is very appreciated if letting us know it in the phonopy mailing list. (install_lapacke)= ## Installation of LAPACKE diff --git a/_static/documentation_options.js b/_static/documentation_options.js index 9e1506d9..e5b78130 100644 --- a/_static/documentation_options.js +++ b/_static/documentation_options.js @@ -1,5 +1,5 @@ const DOCUMENTATION_OPTIONS = { - VERSION: '3.3.0', + VERSION: '3.3.2', LANGUAGE: 'en', COLLAPSE_INDEX: false, BUILDER: 'html', diff --git a/_static/searchtools.js b/_static/searchtools.js index 92da3f8b..b08d58c9 100644 --- a/_static/searchtools.js +++ b/_static/searchtools.js @@ -178,7 +178,7 @@ const Search = { htmlToText: (htmlString, anchor) => { const htmlElement = new DOMParser().parseFromString(htmlString, 'text/html'); - for (const removalQuery of [".headerlinks", "script", "style"]) { + for (const removalQuery of [".headerlink", "script", "style"]) { htmlElement.querySelectorAll(removalQuery).forEach((el) => { el.remove() }); } if (anchor) { @@ -328,13 +328,14 @@ const Search = { for (const [title, foundTitles] of Object.entries(allTitles)) { if (title.toLowerCase().trim().includes(queryLower) && (queryLower.length >= title.length/2)) { for (const [file, id] of foundTitles) { - let score = Math.round(100 * queryLower.length / title.length) + const score = Math.round(Scorer.title * queryLower.length / title.length); + const boost = titles[file] === title ? 1 : 0; // add a boost for document titles normalResults.push([ docNames[file], titles[file] !== title ? `${titles[file]} > ${title}` : title, id !== null ? "#" + id : "", null, - score, + score + boost, filenames[file], ]); } diff --git a/auxiliary-tools.html b/auxiliary-tools.html index 623b19c5..068a58b8 100644 --- a/auxiliary-tools.html +++ b/auxiliary-tools.html @@ -8,7 +8,7 @@ - Auxiliary tools — Phono3py v.3.3.0 + Auxiliary tools — Phono3py v.3.3.2 @@ -36,7 +36,7 @@ - + @@ -134,7 +134,7 @@ -

Phono3py v.3.3.0

+

Phono3py v.3.3.2

@@ -793,6 +793,10 @@

+

+By Author name not set +

+

diff --git a/changelog.html b/changelog.html index ae79a080..f7ce7639 100644 --- a/changelog.html +++ b/changelog.html @@ -8,7 +8,7 @@ - Change Log — Phono3py v.3.3.0 + Change Log — Phono3py v.3.3.2 @@ -36,7 +36,7 @@ - + @@ -133,7 +133,7 @@ -

Phono3py v.3.3.0

+

Phono3py v.3.3.2

@@ -323,6 +323,8 @@

Contents