The Journal of chemical physics
Stochastic representation of time-evolving neural network-based wavefunctions.
Bizi Huang, Weizhong Fu, Ji Chen
Published: 202510.1063/5.0304343
Abstract
Solving the time-dependent Schrödinger equation (TDSE) is pivotal for modeling nonadiabatic electron dynamics, a key process in ultrafast spectroscopy and laser-matter interactions. However, exact solutions to the TDSE remain computationally prohibit…
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