Votca Xtp Save Abandoned

GW-BSE for excited state Quantum Chemistry in a Gaussian Orbital basis, electronic spectroscopy with QM/MM, charge and energy dynamics in complex molecular systems

Project README

The xtp code is now part of votca.

Open Source Agenda is not affiliated with "Votca Xtp" Project. README Source: votca/xtp
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0
Last Commit
2 years ago
Tags
Computational Chemistry Computational Physics Excited States Gw Bse Multiscale Simulation Quantum Chemistry Quantum Classical

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