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physics.chem-ph2019
Control defeseance by anti-alignment in the excited state
Bo Y. Chang, Seokmin Shin, Jesús González-Vázquez +3
We predict anti-alignment dynamics in the excited state of H2+ or related homonuclear dimers in the presence of a strong field. This effect is a general indirect outcome of the str…
physics.chem-ph2019
A grid-based Ehrenfest model to study electron-nuclear processes
Bo Y. Chang, Seokmin Shin, Vladimir S. Malinovsky +1
The two-dimensional electron-nuclear Schrödinger equation using soft-core Coulomb potentials has been a cornerstone for modeling and predicting the behavior of one-active-electron…