home/categories/computational-chemistry/a5c-ai-babysitter-library-specializations-domains-science-quantum-computing-skills-pyscf-interface-skill-md
computational-chemistryresearch
pyscf-interface
PySCF quantum chemistry interface for classical electronic structure calculations
maintainer
a5c-ai
Atualizado 3/25/2026
Estrelas
538
Forks
33
quick start
Installation and usage
PySCF quantum chemistry interface for classical electronic structure calculations
Instalação
$ install --globalskills.sh
Uso
Depois de instalar, você pode usar esta skill executando o seguinte comando no terminal:
skills use pyscf-interface