CORC

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CORC

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Theoretical Framework of 1,3-Thiazolium-5-Thiolates Mesoionic Compounds: Exploring the Nature of Photophysical Property and Molecular Nonlinearity 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2020, 卷号: 124, 期号: 27, 页码: 5563-5569
作者:  Liu, Zeyu;  Tian, Ziqi;  Lu, Tian;  Hua, Shugui
收藏  |  浏览/下载：7/0  |  提交时间：2020/12/16
Long-lived coherence in pentafluorobenzene as a probe of pi pi* - pi sigma* vibronic coupling 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2016, 卷号: 145, 期号: 1
作者:  Hueter, O.;  Sala, M.;  Neumann, H.;  Zhang, S.;  Studzinski, H.
收藏  |  浏览/下载：18/0  |  提交时间：2016/09/05
Ethylene glycol reforming on Pt(111): first-principles microkinetic modeling in vapor and aqueous phases 期刊论文
Catalysis Science & Technology, 2016, 卷号: 6, 期号: 23, 页码: 8242-8256
作者:  Lu, Jianmin;  Faheem, Muhammad;  Saleheen, Mohammad;  Heyden, Andreas
收藏  |  浏览/下载：14/0  |  提交时间：2017/10/29
Are polynuclear superhalogens without halogen atoms probable? A high-level ab initio case study on triple-bridged binuclear anions with cyanide ligands 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2014, 卷号: 140
作者:  Yin, Bing;  Li, Teng;  Li, Jin-Feng;  Yu, Yang;  Li, Jian-Li
收藏  |  浏览/下载：10/0  |  提交时间：2018/07/05
Nonheme Iron Oxidant Formed in the Presence of H2O2 and Acetic Acid Is the Cyclic Ferric Peracetate Complex, Not a Perferryloxo Complex 期刊论文
acs catalysis, 2013, 卷号: 3, 期号: 6, 页码: 1334-1341
作者:  Wang, Yong;  Janardanan, Deepa;  Usharani, Dandamudi;  Han, Keli;  Que, Lawrence, Jr.
收藏  |  浏览/下载：17/0  |  提交时间：2014/09/11
Computational Studies on the Mechanism of the Copper-Catalyzed sp(3)-C-H Cross-Dehydrogenative Coupling Reaction 期刊论文
chempluschem, 2013
Cheng, Gui-Juan; Song, Li-Juan; Yang, Yun-Fang; Zhang, Xinhao; Wiest, Olaf; Wu, Yun-Dong
收藏  |  浏览/下载：4/0  |  提交时间：2015/11/16
XYG3 and XYGJ-OS performances for noncovalent binding energies relevant to biomolecular structures 期刊论文
http://dx.doi.org/10.1039/c2cp40904f, 2012
Zhang, Igor Ying; Xu, Xin; 徐昕
收藏  |  浏览/下载：7/0  |  提交时间：2015/07/22

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