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master
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protected
8c96872b
·
Merge branch 'release-2.3.1' into 'master'
·
Jul 26, 2024
fix-relaxation-with-fixed-cell
f529d173
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Switched from constraints to filter for relaxation with fixed cell or volume
·
Jul 26, 2024
!164
add-function-for-parsing-thermodynamic-data
7e87cc02
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Added function for parsing thermodynamic data
·
Jun 27, 2024
!161
polarizability-gradient
9272d5fb
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make get_polarizability_gradient return a N, 3, 3, 3 tensor
·
Jun 10, 2024
!157
pin-ase-version
271f4f60
·
pin ase version
·
Jun 04, 2024
Stale branches
scp-tutorial
d72d60dd
·
move scp tutorial from old MR
·
Mar 31, 2023
descriptor-gradient
1bb6577a
·
Formatting
·
May 04, 2023
support-for-rotational-sum-rules
7905e0c2
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Added hiphive to Docker image
·
Jul 11, 2023
fix-ase-expfilter-import
844df340
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Updated import of ExpCellFilter from ase
·
Dec 24, 2023
add-hiphive-to-ci
f92d9f21
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Added hiphive to CI
·
Dec 25, 2023
!138