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Al-ABACUS
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[pre-commit.ci] auto fixes from pre-commit.com hooks
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2022-07-18 08:51:00 +00:00 |
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Al-Fleur
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Refactoring using formatter
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2021-10-17 08:11:06 +09:00 |
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Al-QHA
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[pre-commit.ci] auto fixes from pre-commit.com hooks
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2024-01-29 21:19:59 +00:00 |
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Al2O3
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Update examples to recommend phonopy-load
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2024-08-12 15:30:57 +09:00 |
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CaTiO3
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Refactoring using formatter
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2021-10-17 08:11:06 +09:00 |
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Cr
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Update phonopy_disp.yaml in Cr example
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2024-09-21 15:01:16 +09:00 |
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Cr-castep
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Refactoring using formatter
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2021-10-17 08:11:06 +09:00 |
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Cu-QHA
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Refactoring using formatter
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2021-10-17 08:11:06 +09:00 |
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Graphene-siesta
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Refactoring using formatter
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2021-10-17 08:11:06 +09:00 |
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KCl-SSCHA
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Update pypolymlp doc
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2025-03-03 11:23:21 +09:00 |
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LiF-nosym
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Update examples to recommend phonopy-load
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2024-08-12 15:30:57 +09:00 |
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MgB2
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Update examples to recommend phonopy-load
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2024-08-12 15:30:57 +09:00 |
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MgO
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Update examples to recommend phonopy-load
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2024-08-12 15:30:57 +09:00 |
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NaCl
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Update examples to recommend phonopy-load
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2024-08-12 15:30:57 +09:00 |
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NaCl-CP2K
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Collection of minor updates around parsing input files, mainly crystal structure
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2020-02-25 14:37:23 +09:00 |
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NaCl-CRYSTAL
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Refactoring using formatter
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2021-10-17 08:11:06 +09:00 |
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NaCl-PWmat
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[pre-commit.ci] auto fixes from pre-commit.com hooks
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2024-03-22 08:16:27 +00:00 |
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NaCl-QE
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Update examples to recommend phonopy-load
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2024-08-12 15:30:57 +09:00 |
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NaCl-QE-q2r
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Update document
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2024-06-06 10:11:59 +09:00 |
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NaCl-VASPdfpt
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Update examples to recommend phonopy-load
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2024-08-12 15:30:57 +09:00 |
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NaCl-abinit
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Refactoring using formatter
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2021-10-17 08:11:06 +09:00 |
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NaCl-castep
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Refactoring using formatter
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2021-10-17 08:11:06 +09:00 |
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NaCl-gruneisen
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Refactoring using formatter
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2021-10-17 08:11:06 +09:00 |
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NaCl-rd
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Update examples to recommend phonopy-load
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2024-08-12 15:30:57 +09:00 |
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NaCl-wien2k
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Update examples to recommend phonopy-load
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2024-08-12 15:30:57 +09:00 |
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NaCl-wien2k-P1
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Update examples to recommend phonopy-load
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2024-08-12 15:30:57 +09:00 |
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Si
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Update examples to recommend phonopy-load
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2024-08-12 15:30:57 +09:00 |
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Si-CP2K
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cp2k: implement full cell spec parsing
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2019-10-10 11:10:20 +02:00 |
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Si-CRYSTAL
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Refactoring using formatter
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2021-10-17 08:11:06 +09:00 |
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Si-PWmat
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[pre-commit.ci] auto fixes from pre-commit.com hooks
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2024-03-22 08:16:27 +00:00 |
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Si-QE
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Update examples to recommend phonopy-load
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2024-08-12 15:30:57 +09:00 |
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Si-QHA
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[pre-commit.ci] auto fixes from pre-commit.com hooks
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2024-01-29 21:19:59 +00:00 |
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Si-TURBOMOLE
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Refactoring using formatter
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2021-10-17 08:11:06 +09:00 |
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Si-abinit
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Refactoring using formatter
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2021-10-17 08:11:06 +09:00 |
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Si-elk
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Refactoring using formatter
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2021-10-17 08:11:06 +09:00 |
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Si-gruneisen
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Add from __future__ import annotations
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2024-06-18 09:08:01 +09:00 |
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Si-lammps
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[pre-commit.ci] auto fixes from pre-commit.com hooks
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2024-01-29 21:19:59 +00:00 |
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Si-nosym
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Refactoring using formatter
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2021-10-17 08:11:06 +09:00 |
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Si-siesta
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Refactoring using formatter
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2021-10-17 08:11:06 +09:00 |
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SiO2-CP2K-xyz
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Add docstrings in python scripts in example/SiO2-CP2K-xyz
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2025-02-21 07:43:51 +09:00 |
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SiO2-HP
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Update examples to recommend phonopy-load
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2024-08-12 15:30:57 +09:00 |
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SnO2
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Update examples to recommend phonopy-load
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2024-08-12 15:30:57 +09:00 |
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Ti-lammps
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Add Si-lammps example
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2023-05-12 10:00:34 +09:00 |
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TiO2-anatase
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Update examples to recommend phonopy-load
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2024-08-12 15:30:57 +09:00 |
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ZnO
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Update examples to recommend phonopy-load
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2024-08-12 15:30:57 +09:00 |
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diamond-FHI-aims
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Refactoring using formatter
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2021-10-17 08:11:06 +09:00 |
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diamond-dftb
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Refactoring using formatter
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2021-10-17 08:11:06 +09:00 |
2a4f1aec27