73 citations · 281 across the 13 of their papers we have counts for
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physics.chem-ph2016
Fully quantum non-adiabatic dynamics in electronic-nuclear coherent state basis
Alexander Humeniuk, Roland Mitric
Direct dynamics methods using Gaussian wavepackets have to rely only on local properties, such as gradients and hessians at the center of the wavepacket, so as to be compatible wit…
physics.chem-ph2016★ 10 cited
Non-Adiabatic Dynamics around a Conical Intersection with Surface-Hopping Coupled Coherent States
Alexander Humeniuk, Roland Mitrić
An extension of the CCS-method [Chem. Phys. 2004, 304, p. 103-120] for simulating non-adiabatic dynamics with quantum effects of the nuclei is put forward. The time-dependent Schrö…