qcengine
A wrapper for Quantum Chemistry engines that adheres to the MolSSI (molssi.org) QCSchema.
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Summary
A wrapper for Quantum Chemistry engines that adheres to the MolSSI (molssi.org) QCSchema.
Last Updated
Feb 1, 2026 at 07:17
License
BSD-3-Clause
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0
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0
GitHub Repository
http://github.com/MolSSI/QCEngineDocumentation
https://molssi.github.io/QCEngine/