Actions: materialsproject/pymatgen
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from_ase_atoms
for Molecule
Tests
#9487:
Pull request #4321
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DanielYang59
from_ase_atoms
for Molecule
Tests
#9486:
Pull request #4321
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DanielYang59
from_ase_atoms
for Molecule
Tests
#9485:
Pull request #4321
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DanielYang59
from_ase_atoms
for Molecule
Tests
#9481:
Pull request #4321
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DanielYang59
from_ase_atoms
for Molecule
Tests
#9480:
Pull request #4321
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from_ase_atoms
for Molecule
Tests
#9479:
Pull request #4321
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DanielYang59
from_ase_atoms
for Molecule
Tests
#9478:
Pull request #4321
opened
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SymmetrizedStructure
MSONable
Tests
#9476:
Pull request #4296
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DanielYang59
io.vasp.outputs.get_band_structure_from_vasp_multiple_branches
Tests
#9475:
Pull request #4061
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monty
imports, enhance test for Outcar
parser to cover uncompressed format
Tests
#9474:
Pull request #4068
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DanielYang59
PymatgenTest
, migrate tests to pytest
from unittest
Tests
#9473:
Pull request #4212
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DanielYang59