Pinned Repositories
aiida-core
The official repository for the AiiDA code
cclib
Parsers and algorithms for computational chemistry logfiles
aiida-aimall
aiida-core
The official repository for the AiiDA code
aiida-registry
Find plugins for AiiDA
aiida-unsealed-workchain
Files for reproducing an error in AiiDA resulting in an unsealed excepted WorkChain
compchem-si
group_decomposition
subproptools
Tools developed by KLG - parsing of .sum files in qtaimExtract, reorientation in subreor
PySR
High-Performance Symbolic Regression in Python and Julia
kmlefran's Repositories
kmlefran/aiida-aimall
kmlefran/aiida-core
The official repository for the AiiDA code
kmlefran/aiida-registry
Find plugins for AiiDA
kmlefran/aiida-unsealed-workchain
Files for reproducing an error in AiiDA resulting in an unsealed excepted WorkChain
kmlefran/compchem-si
kmlefran/group_decomposition
kmlefran/subproptools
Tools developed by KLG - parsing of .sum files in qtaimExtract, reorientation in subreor