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Change generate_deformations to return strain_inds and space group nu… Run the Abipy test suite. #123: Commit 1eaf333 pushed by gmatteo
December 21, 2024 15:10 20m 36s develop
develop
December 21, 2024 15:10 20m 36s
dos --> phdos Run the Abipy test suite. #122: Commit cf13770 pushed by gmatteo
December 21, 2024 11:59 19m 38s develop
develop
December 21, 2024 11:59 19m 38s
Fix examples Run the Abipy test suite. #121: Commit a09912f pushed by gmatteo
December 19, 2024 16:46 21m 11s develop
develop
December 19, 2024 16:46 21m 11s
abort on example error in gallery Run the Abipy test suite. #120: Commit 9735a3d pushed by gmatteo
December 19, 2024 16:28 2m 10s develop
develop
December 19, 2024 16:28 2m 10s
Use same settings as Samare Run the Abipy test suite. #119: Commit 7f1f607 pushed by gmatteo
December 19, 2024 16:20 2m 9s develop
develop
December 19, 2024 16:20 2m 9s
qha_aproximation.py --> vzsisa.py Run the Abipy test suite. #118: Commit b46b593 pushed by gmatteo
December 19, 2024 15:51 2m 12s develop
develop
December 19, 2024 15:51 2m 12s
Add structure.as_ngkpt method Run the Abipy test suite. #117: Commit d782893 pushed by gmatteo
December 19, 2024 12:07 22m 53s develop
develop
December 19, 2024 12:07 22m 53s
Add run_qha_vzsisa.py flow script Run the Abipy test suite. #116: Commit 20e6c5d pushed by gmatteo
December 18, 2024 15:51 2m 41s develop
develop
December 18, 2024 15:51 2m 41s
Fix syntax warnings Run the Abipy test suite. #115: Commit b7f3afd pushed by gmatteo
December 15, 2024 15:51 22m 45s develop
develop
December 15, 2024 15:51 22m 45s
Don't invoke open in Makefile Run the Abipy test suite. #114: Commit 22c246c pushed by gmatteo
December 15, 2024 14:49 22m 45s develop
develop
December 15, 2024 14:49 22m 45s
Code cleanup Run the Abipy test suite. #113: Commit 5d17288 pushed by gmatteo
December 15, 2024 14:18 22m 39s develop
develop
December 15, 2024 14:18 22m 39s
Move classmethods before __init__ to improve readability Run the Abipy test suite. #112: Commit 861c9b8 pushed by gmatteo
December 15, 2024 10:50 22m 36s develop
develop
December 15, 2024 10:50 22m 36s
Code cleanup in qha_aproximation.py Run the Abipy test suite. #111: Commit 2c53c9a pushed by gmatteo
December 14, 2024 23:26 22m 42s develop
develop
December 14, 2024 23:26 22m 42s
Try phonopy<=2.31.2 Run the Abipy test suite. #110: Commit 916dfbb pushed by gmatteo
December 14, 2024 16:58 22m 21s develop
develop
December 14, 2024 16:58 22m 21s
Require phonopy<=2.32.0 Run the Abipy test suite. #109: Commit e25f9fa pushed by gmatteo
December 14, 2024 16:15 22m 44s develop
develop
December 14, 2024 16:15 22m 44s
Pin monty version to v2024.10.21 Run the Abipy test suite. #108: Commit b3fdf60 pushed by gmatteo
December 14, 2024 15:15 19m 59s develop
develop
December 14, 2024 15:15 19m 59s
pin pymatgen to v2024.10.29 to avoid bug introduced in pseudos Run the Abipy test suite. #107: Commit e74ccab pushed by gmatteo
December 14, 2024 15:00 12m 27s develop
develop
December 14, 2024 15:00 12m 27s
Improve coverage of qha_approximation.py Run the Abipy test suite. #106: Commit 256d219 pushed by gmatteo
December 14, 2024 13:26 12m 39s develop
develop
December 14, 2024 13:26 12m 39s
Cosmetic changes in qha_aproximation.py Run the Abipy test suite. #105: Commit b3ab4a0 pushed by gmatteo
December 12, 2024 22:19 12m 30s develop
develop
December 12, 2024 22:19 12m 30s
Add test_qha_general_stress.py Run the Abipy test suite. #104: Commit 8aedb34 pushed by gmatteo
December 12, 2024 19:29 12m 48s develop
develop
December 12, 2024 19:29 12m 48s
Add test_qha_2d.py plot_qha_2d.py Run the Abipy test suite. #103: Commit cab90ca pushed by gmatteo
December 12, 2024 14:51 12m 48s develop
develop
December 12, 2024 14:51 12m 48s
Add plot_qha_v-ZSISA.py and preliminary tests in test_qha_approximati… Run the Abipy test suite. #102: Commit a7dc13b pushed by gmatteo
December 12, 2024 13:46 12m 51s develop
develop
December 12, 2024 13:46 12m 51s
Added submodule for example data Run the Abipy test suite. #101: Commit 2e41eac pushed by gmatteo
December 12, 2024 12:33 12m 11s develop
develop
December 12, 2024 12:33 12m 11s
scripts for ZSISA-QHA (#306) Run the Abipy test suite. #100: Commit 0fb0506 pushed by gmatteo
December 12, 2024 11:59 12m 21s develop
develop
December 12, 2024 11:59 12m 21s
scripts for ZSISA-QHA Run the Abipy test suite. #99: Pull request #306 opened by samarerstm
December 12, 2024 10:50 12m 17s samarerstm:develop
samarerstm:develop
December 12, 2024 10:50 12m 17s