AlphaUncommon
mzjb/DeepH-pack
Deep neural networks for density functional theory Hamiltonian.
- Owner
- mzjb (personal account)
- Stars
- Stars: 346
- Forks
- Forks: 72
- Language
- Python
- License
- LGPL-3.0
- Created
- 2022
- Topics
- deephhamiltoniandftjuliapytorchequivariant-networkdensity-functional-theoryfirst-principles-calculationsphysicsab-initio-simulations
- Tier
- Alpha (250 to 699 ★) What this tier means
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