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Extracting Vibrational Anharmonicities from Short Driven Molecular Dynamics Trajectories

Parneix Pascal,Maupin Romain,Attal Loïse,Calvo Florent, University Grenoble Alpes

Theoretical Chemistry Accounts（2021）

Cited 1|Views8
Key words
Anharmonicities,Driven molecular dynamics,Perturbation theory
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