Extended Hamiltonian molecular dynamics: Semiclassical trajectories with improved maintenance of zero point energy

Yinan Shu, Sijia S. Dong, Kelsey A. Parker, Junwei L. Bao, Linyao Zhang, Donald G. Truhlar

Research output: Contribution to journalArticlepeer-review

3 Scopus citations

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Physics & Astronomy

Chemical Compounds