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1 Ergebnisse
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Extended Hamiltonian molecular dynamics: semiclassical traj..:
Shu, Yinan
;
Dong, Sijia S.
;
Parker, Kelsey A.
...
Physical Chemistry Chemical Physics. 20 (2018) 48 - p. 30209-30218 , 2018
Link:
https://doi.org/10.1039/c8cp04914a
RT Journal T1 <Title>Extended Hamiltonian molecular dynamics: semiclassical trajectories with improved maintenance of zero point energy</Title> UL https://suche.suub.uni-bremen.de/peid=cr-10.1039_c8cp04914a&Exemplar=1&LAN=DE A1 Shu, Yinan A1 Dong, Sijia S. A1 Parker, Kelsey A. A1 Bao, Junwei L. A1 Zhang, Linyao A1 Truhlar, Donald G. PB Royal Society of Chemistry (RSC) YR 2018 SN 1463-9076 SN 1463-9084 JF Physical Chemistry Chemical Physics VO 20 IS 48 SP 30209 OP 30218 LK http://dx.doi.org/https://doi.org/10.1039/c8cp04914a DO https://doi.org/10.1039/c8cp04914a SF ELIB - SuUB Bremen
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