optking
A molecular optimizer for Quantum Chemistry calculations.
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About
Summary
A molecular optimizer for Quantum Chemistry calculations.
Last Updated
Dec 6, 2022 at 06:44
License
BSD-3-Clause
Total Downloads
29.9K
Supported Platforms
noarch
GitHub Repository
https://github.com/psi-rking/optking.gitDocumentation
https://optking.readthedocs.io/en/latest/