Browsing Science (Faculty of) by Subject "vecc"
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Equilibrium and dynamical computation schemes for vibronic models of nonadiabatic systems
(University of Waterloo, 2023-01-06)Two computational schemes were investigated for studying vibronic models of nonadiabatic systems: Path Integral Monte Carlo (PIMC) and vibrational electronic coupled cluster (VECC). A PIMC method was used to investigate ...