|
c
|
Some refactoring and minor fixes
|
2019-10-12 08:34:36 +09:00 |
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conda
|
Update to avoid error in travis-CI
|
2019-09-26 16:32:34 +02:00 |
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doc
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doc: add documentation for CP2K
|
2019-10-10 11:10:21 +02:00 |
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example
|
example: add NaCl with CP2K
|
2019-10-10 11:10:22 +02:00 |
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phonopy
|
Some refactoring and minor fixes
|
2019-10-12 08:34:36 +09:00 |
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scripts
|
Updated band plot tool
|
2019-08-21 11:53:29 +09:00 |
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test
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test/interface: add test for parsing CP2K input
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2019-10-10 11:10:22 +02:00 |
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.gitignore
|
Update setup.py for packaging
|
2013-02-07 14:56:59 +09:00 |
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.travis.yml
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test/interface: add test for parsing CP2K input
|
2019-10-10 11:10:22 +02:00 |
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LICENSE
|
Add the name of phonopy project on LICENSE file
|
2016-11-29 07:23:29 +09:00 |
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MANIFEST.in
|
Add license to manifest.in
|
2016-11-28 23:32:14 +01:00 |
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README.md
|
Update README.md
|
2016-10-29 20:01:41 +09:00 |
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build-wheels.sh
|
Update .travis.yml to create wheel of phonopy
|
2019-09-25 16:39:49 +02:00 |
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dev-requirements.txt
|
Update .travis.yml to create wheel of phonopy
|
2019-09-25 16:39:49 +02:00 |
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get_nanoversion.sh
|
Fix __nanoversion__.txt
|
2018-11-22 13:43:26 +09:00 |
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pyproject.toml
|
add pyproject.toml to declare numpy as build dependency
|
2019-07-26 12:55:30 +02:00 |
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requirements.txt
|
Update setup for travis-CI deployment
|
2016-10-22 23:02:14 +09:00 |
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setup-sanitizer.py
|
Add setup script for memory sanitizer
|
2016-12-05 14:19:49 +09:00 |
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setup.py
|
cp2k: implement full cell spec parsing
|
2019-10-10 11:10:20 +02:00 |
918b07e194
