A TD-DFT Study on the Photo-Physicochemical Properties of Chrysophanol from Rheum

by Dezhan Chen, Zhiqiang Shi, Zebao Zheng, Shuai Feng, Xue Zhao
Published 2009-07-01

Charge-Shift Bonding in Xenon Hydrides: An NBO/NRT Investigation on HXeY···HX (Y = Cl, Br, I; X = OH, Cl, Br, I, CCH, CN) via H-Xe Blue-Shift Phenomena

by Guiqiu Zhang, Yue Su, Xiaoran Zou, Lei Fu, Junjie Song, Dezhan Chen, Chuanzhi Sun
Published 2020-04-01