Pinned Repositories
MOFTransformer
Universal Transfer Learning in Porous Materials, including MOFs.
AIMNet2
AIMNet2
MOFTransformer
Universal Transfer Learning in Porous Materials, including MOFs.
neb_visualize
script to visualize results from an ORCA NEB run
Eco2AI
eco2AI is a python library which accumulates statistics about power consumption and CO2 emission during running code.
neb_visualize
script to visualize results from an ORCA NEB run
Mirual's Repositories
Mirual/AIMNet2
Mirual/MOFTransformer
Universal Transfer Learning in Porous Materials, including MOFs.
Mirual/neb_visualize
script to visualize results from an ORCA NEB run