A Globally Accurate Neural Network Potential Energy Surface and Quantum Dynamics Studies on Be+(2S) + H2/D2 → BeH+/BeD+ + H/D Reactions

Zijiang Yang, Furong Cao, Huiying Cheng, Siwen Liu,Jingchang Sun

MOLECULES（2024）

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potential energy surface,quantum dynamics,ab initio,neural network,time-dependent wave packet

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