blokhin
Evgeny Blokhin
1 repositories
https://orcid.org/0000-0002-5333-3947

pycrystal

Utilities for ab initio modeling suite CRYSTAL, developed in Turin University

crystal crystallography computational-chemistry abinitio abinitio-simulations atomistic-simulations computational-materials crystal-ab-initio crystal-structure emsl first-principles gaussian gaussian-lcao materials-science
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