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interlayer_energies_demo
interlayer_energies_demo PublicA demo which allows one to easily access QMC data for interlayer interactions of graphene
Python 2
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bilayer_tight_binding
bilayer_tight_binding PublicPublication-ready directory for single and bi-layer graphene DFT tight-binding models under lattice deformation.
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documentation
documentation PublicHere we will collect notes about the infrastructure in the collaboration.
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- M18-hydrogen Public
M18 MACE model trained on QMC data for use in molecular hydrogen melting calculations
qmc-hamm/M18-hydrogen’s past year of commit activity - qmc-hamm.github.io Public
qmc-hamm/qmc-hamm.github.io’s past year of commit activity - mace Public Forked from ACEsuit/mace
MACE - Fast and accurate machine learning interatomic potentials with higher order equivariant message passing.
qmc-hamm/mace’s past year of commit activity - qmc_graphene_stacking_fault Public
qmc-hamm/qmc_graphene_stacking_fault’s past year of commit activity - qmc_hydrogen Public
qmc-hamm/qmc_hydrogen’s past year of commit activity - bilayer_tight_binding Public
Publication-ready directory for single and bi-layer graphene DFT tight-binding models under lattice deformation.
qmc-hamm/bilayer_tight_binding’s past year of commit activity - graphene_optimized_geometry Public
Twisted bilayer graphene structures are optimized by molecular dynamics calculations and density functional theory calculations.
qmc-hamm/graphene_optimized_geometry’s past year of commit activity - interlayer_energies_demo Public
A demo which allows one to easily access QMC data for interlayer interactions of graphene
qmc-hamm/interlayer_energies_demo’s past year of commit activity
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