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BaGa2-wien2k.yaml
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Move tests from test/phonopy/* test/
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2018-07-31 09:37:00 +09:00 |
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BaGa2.struct
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Move tests from test/phonopy/* test/
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2018-07-31 09:37:00 +09:00 |
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FORCE_SETS_NaCl
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Move tests from test/phonopy/* test/
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2018-07-31 09:37:00 +09:00 |
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NaCl-abinit-pwscf.yaml
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Move tests from test/phonopy/* test/
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2018-07-31 09:37:00 +09:00 |
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NaCl-abinit.in
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Move tests from test/phonopy/* test/
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2018-07-31 09:37:00 +09:00 |
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NaCl-pwscf.in
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Move tests from test/phonopy/* test/
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2018-07-31 09:37:00 +09:00 |
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NaCl-vasp.yaml
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Move tests from test/phonopy/* test/
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2018-07-31 09:37:00 +09:00 |
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Si-CP2K.inp
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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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Si-CP2K.yaml
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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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Si-CRYSTAL.o
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Move tests from test/phonopy/* test/
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2018-07-31 09:37:00 +09:00 |
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Si-CRYSTAL.yaml
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Move tests from test/phonopy/* test/
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2018-07-31 09:37:00 +09:00 |
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Si-TURBOMOLE-control
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Improve TURBOMOLE interface to accept coordinates embedded in the control file.
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2019-03-26 09:53:23 +02:00 |
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Si-TURBOMOLE.yaml
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TURBOMOLE interface, including example, test, and documentation.
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2019-03-25 00:11:03 +02:00 |
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__init__.py
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Move tests from test/phonopy/* test/
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2018-07-31 09:37:00 +09:00 |
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phonopy.yaml
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Move tests from test/phonopy/* test/
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2018-07-31 09:37:00 +09:00 |
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test_CP2K.py
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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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test_CRYSTAL.py
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BAND = AUTO was implemented and phonopy.load was augmented.
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2018-11-22 12:45:32 +09:00 |
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test_TURBOMOLE.py
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Improve TURBOMOLE interface to accept coordinates embedded in the control file.
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2019-03-26 09:53:23 +02:00 |
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test_abinit.py
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BAND = AUTO was implemented and phonopy.load was augmented.
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2018-11-22 12:45:32 +09:00 |
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test_phonopy_yaml.py
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Add base phonopy yaml interface unittest.
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2020-01-29 16:32:20 +00:00 |
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test_pwscf.py
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BAND = AUTO was implemented and phonopy.load was augmented.
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2018-11-22 12:45:32 +09:00 |
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test_vasp.py
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BAND = AUTO was implemented and phonopy.load was augmented.
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2018-11-22 12:45:32 +09:00 |
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test_wien2k.py
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BAND = AUTO was implemented and phonopy.load was augmented.
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2018-11-22 12:45:32 +09:00 |
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vasprun.xml.tar.bz2
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Move tests from test/phonopy/* test/
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2018-07-31 09:37:00 +09:00 |
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