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Quantum-Accelerators / quacc Public

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Allow for setting of NBO path in Q-Chem settings#955

Merged

Andrew-S-Rosen merged 6 commits intomainQuantum-Accelerators/quacc:mainfrom nbo_pathQuantum-Accelerators/quacc:nbo_pathCopy head branch name to clipboard

Sep 18, 2023

+14-1

Conversation Commits6 (6)Checks Files changed

Commits

Commits on Sep 18, 2023

Allow for setting of NBO path
Andrew-S-Rosen
committed
add NBO
Andrew-S-Rosen
committed
Update qchem.py
Andrew-S-Rosen
authored
Update qchem.py
Andrew-S-Rosen
authored
Merge branch 'main' into nbo_path
Andrew-S-Rosen
authored
Update qchem.py
Andrew-S-Rosen
authored

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