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quant-ph2024★ 5 cited
Fermi's golden rule rate expression for transitions due to nonadiabatic derivative couplings in the adiabatic basis
Seogjoo J. Jang, Byeong Ki Min, Young Min Rhee
Starting from a general molecular Hamiltonian expressed in the basis of adiabatic electronic and nuclear position states, where a compact and complete expression for nonadiabatic d…
quant-ph2023★ 3 cited
Simple and general unitarity conserving numerical real time propagators of time dependent Schrödinger equation based on Magnus expansion
Taner M. Ture, Seogjoo J. Jang
Magnus expansion (ME) provides a general way to expand the real-time propagator of a time-dependent Hamiltonian within the exponential such that the unitarity is satisfied at any o…