95. Siting Hou, Zejie Zhang, and Changjian Xie*, “Constructing Diabatic Potential Energy Matrices with Quantum Dynamic Accuracy: A Neural Network Based Δ-Machine Learning Approach”, J. Chem. Theory Comput. 22, 2089–2103 (2026)
Release time:2026-03-27 Hits:
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Pre One:96. Zhibing Lu, Siting Hou, Peng Wang, Yu Zhang, Shihao Li, Fuyan Wu, Fan Li, Rongjing Guo, Daofu Yuan, Changjian Xie*, Kaijun Yuan, David H. Parker, Xueming Yang, Xingan Wang*, “Observation of the Parity-Dependent Nonadiabatic Photodissociation of trans-HONO”, JACS Au 6, 1860–1867 (2026), (Editors’ Choice)
Next One:94. Siting Hou, Jiawen Liu, Zejie Zhang, and Changjian Xie*, “Vibrational state control of HPCO photodissociation in the S1 band”, J. Chem. Phys. 164, 024307 (2026), (Invited article for the Special Topic, “Simulation of Excited State Dynamics in Molecular and Condensed-Matter Systems”)
