161 citations · 386 across the 6 of their papers we have counts for
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physics.chem-ph2017★ 161 cited
On-the-fly CASPT2 surface hopping dynamics
Jae Woo Park, Toru Shiozaki
We report the development of programs for on-the-fly surface hopping dynamics simulations in the gas and condensed phases on the potential energy surfaces computed by multistate mu…
physics.chem-ph2017★ 161 cited
Analytical derivative coupling for multistate CASPT2 theory
Jae Woo Park, Toru Shiozaki
The probability of non-radiative transitions in photochemical dynamics is determined by the derivative couplings, the couplings between different electronic states through the nucl…