Skip to content
Open
Changes from all commits
Commits
File filter

Filter by extension

Filter by extension


Conversations
Failed to load comments.
Loading
Jump to
Jump to file
Failed to load files.
Loading
Diff view
Diff view
2 changes: 1 addition & 1 deletion pyproject.toml
Original file line number Diff line number Diff line change
Expand Up @@ -57,7 +57,7 @@ phonons = ["phonopy>=2.43,<5", "seekpath>=2.0.0"]
pheasy = ["atomate2[phonons,alamode]", "hiphive==1.5", "numpy<=2.2", "pheasy @ git+https://gitlab.com/hpsahasrabuddhe/pheasy.git@9f24162a4ed0f0ab8911d382fd2617944aade55d"]
# phono3py computes the mode Grueneisen tensors in the thermal expansion workflow
# phonors 0.5 breaks the Grueneisen q-point mesh of phonopy and phono3py 4.5
phono3py = ["atomate2[phonons]", "phono3py==4.5.0", "phonors<0.5"]
phono3py = ["atomate2[phonons]", "phono3py==4.7.0", "phonors<0.5"]
alamode = ["alm @ git+https://github.com/ttadano/ALM.git@f1d668fdee66e7e7218a04c88daf19d0e14fce0c#subdirectory=python"]
hiphive = ["hiphive==1.5", "trainstation>=1.0", "atomate2[phonons,alamode]"]
lobster = ["ijson>=3.2.2", "lobsterpy>=0.6.0"]
Expand Down
Loading