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Shuo Yang, Zhaojun Zhang, Dong H Zhang
Xiaoren Zhang, Zhaojun Zhang, Fabien Gatti
Yan-Lin Fu, Xiaoxiao Lu, Yong-Chang Han
Jiayu Huang, Dong H Zhang

Vibrational Spectra of a N719-Chromophore/Titania Interface from Empirical-Potential Molecular-Dynamics Simulation, Solvated by a Room Temperature Ionic Liquid
Published on : Jan 25, 2020

Isotopic Effect in Double Proton Transfer Process of Porphycene Investigated by Enhanced QM/MM Method
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Computation of Atmospheric Concentrations of Molecular Clusters from <em>ab initio</em> Thermochemistry
Published on : Apr 08, 2020