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tilde-lab
pycrystal

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

381 11 1
espenfl
t4me

T4ME - Transport 4 MatErials - A code to calculate the charge transport in materials, from analytic models and ab-initio

192 6 5
geem-lab
overreact

⚛️📈 Create and analyze chemical microkinetic models built from computational chemistry data

162 62 10
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