GitHub topics: compuational-chemistry
MolSSI/QCArchiveExamples
Getting started docs, examples, tutorials, and use cases.
Language: Jupyter Notebook - Size: 6.8 MB - Last synced at: over 2 years ago - Pushed at: about 4 years ago - Stars: 11 - Forks: 6
lcbc-epfl/perovskites-distortions
Collection of useful functions to manipulate/analyse the structures of hybrid organic-inorganic perovskites
Language: Python - Size: 5.86 KB - Last synced at: over 2 years ago - Pushed at: about 3 years ago - Stars: 2 - Forks: 1
