Ecosyste.ms: Packages

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conda-forge.org : koopmans-kcp

koopmans-kcp is an implementation of Koopmans functionals in Quantum ESPRESSO v4.1 with full orbital optimization. Instead of using this as a stand-alone code, it is strongly recommended you install and use the larger koopmans package <https://koopmans-functionals.org>.

Registry - Source - JSON
purl: pkg:conda/koopmans-kcp
Keywords: electronic-structure, koopmans-functionals, quantum-espresso
License: GPL-2.0-only
Latest release: over 1 year ago
First release: over 1 year ago
Stars: 0 on GitHub
Forks: 0 on GitHub
See more repository details: repos.ecosyste.ms
Last synced: 22 days ago

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