Non-adiabatic Matsubara dynamics and non-adiabatic ring-polymer molecular dynamics
Author:
Affiliation:
1. Department of Chemistry, University of Rochester, 120 Trustee Road, Rochester, New York 14627, USA
2. Hajim School of Engineering, The Institute of Optics, University of Rochester, Rochester, New York 14627, USA
Funder
National Science Foundation
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
https://aip.scitation.org/doi/am-pdf/10.1063/5.0042136
Reference118 articles.
1. The multi-configurational time-dependent Hartree approach
2. The multiconfiguration time-dependent Hartree (MCTDH) method: a highly efficient algorithm for propagating wavepackets
3. Multilayer formulation of the multiconfiguration time-dependent Hartree theory
4. Gaussian-based multiconfiguration time-dependent Hartree: A two-layer approach. II. Application to vibrational energy transport in a molecular chain
5. MCTDH on-the-fly: Efficient grid-based quantum dynamics without pre-computed potential energy surfaces
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