troyvvgroup/quemb

QuEmb is an open-source tool for efficient quantum chemistry simulation of large molecules and solids (1D and 2D periodic systems) via bootstrap embedding technique.

PythonStars 10Forks 4Watchers 10Open issues 54License Apache License 2.0
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Ownertroyvvgroup
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Last pushed2025-12-13
Last updated2025-12-14
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