机构

• 近代物理研究所 [7]
• 大连化学物理研究所 [1]
• 中国科学院大学 [1]

采集方式

• OAI收割 [8]
• iSwitch采集 [1]

内容类型

• 期刊论文 [9]

发表日期

• 2010 [1]
• 2009 [1]
• 2008 [5]
• 2007 [2]

学科主题

筛选

浏览/检索结果: 共9条，第1-9条 帮助 条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择题名升序题名降序提交时间升序提交时间降序作者升序作者降序发表日期升序发表日期降序 New Implementations of MRCI in Semiempirical Frameworks 期刊论文  OAI收割 JOURNAL OF COMPUTATIONAL CHEMISTRY, 2010, 卷号: 31, 页码: 1752-1758 作者:  Lei, Yibo;  Suo, Bingbing;  Dou, Yusheng;  Wang, Yubin;  Wen, Zhenyi   |  收藏  |  浏览/下载：10/0  |  提交时间：2018/05/31 semiempirical methods  multireference CI  hole-particle symmetry  doubly contracted CI   Semiclassical dynamic simulation of photon induced ring-opening of cyclohexadiene to hexatriene 期刊论文  OAI收割 CHEMICAL PHYSICS LETTERS, 2009, 卷号: 478, 页码: 28-32 作者:  Li, Anyang;  Yuan, Shuai;  Dou, Yusheng;  Wang, Yubin;  Wen, Zhenyi   |  收藏  |  浏览/下载：21/0  |  提交时间：2018/05/31 Nonadiabatic simulation study of photoisomerization of azobenzene: Detailed mechanism and load-resisting capacity 期刊论文  OAI收割 JOURNAL OF CHEMICAL PHYSICS, 2008, 卷号: 129, 页码: 9 作者:  Shao, Junfeng;  Lei, Yibo;  Wen, Zhenyi;  Dou, Yusheng;  Wang, Zhisong   |  收藏  |  浏览/下载：20/0  |  提交时间：2018/05/31 Detailed dynamics of the nonradiative deactivation of adenine: A semiclassical dynamics study 期刊论文  OAI收割 JOURNAL OF PHYSICAL CHEMISTRY A, 2008, 卷号: 112, 页码: 8497-8504 作者:  Lei, Yibo;  Yuan, Shuai;  Dou, Yusheng;  Wang, Yubin;  Wen, Zhenyi   |  收藏  |  浏览/下载：13/0  |  提交时间：2018/05/31 Involvement of excited triplet state in the photodissociation of cyclobutane 期刊论文  OAI收割 INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2008, 卷号: 108, 页码: 788-796 作者:  Lei, Yibo;  Suo, Bingbing;  Li, Anyang;  Dou, Yusheng;  Wang, Yubin   |  收藏  |  浏览/下载：18/0  |  提交时间：2018/05/31 simulation  potential energy curves  triplet intermediate  MRCISD   Dynamic simulation study on ultrafast excited-state torsional dynamics of 9,9 '-bianthryl (BA) in gas phase: Real-time observation of novel oscillation behavior with the torsional coordinate 期刊论文  OAI收割 chemical physics letters, 2008, 卷号: 453, 期号: 1-3, 页码: 29-34 作者:  Zhao, Guang-Jiu;  Liu, Yu-Hui;  Han, Ke-Li;  Dou, Yusheng 收藏  |  浏览/下载：18/0  |  提交时间：2015/11/11 Dynamic simulation study on ultrafast excited-state torsional dynamics of 9,9 '-bianthryl (ba) in gas phase: real-time observation of novel oscillation behavior with the torsional coordinate 期刊论文  iSwitch采集 Chemical physics letters, 2008, 卷号: 453, 期号: 1-3, 页码: 29-34 作者:  Zhao, Guang-Jiu;  Liu, Yu-Hui;  Han, Ke-Li;  Dou, Yusheng 收藏  |  浏览/下载：27/0  |  提交时间：2019/05/10 Potential energy curves for the X-1 Sigma(+)(g), B-1 Delta(g) and B'(1) Sigma(+)(g) states of C-2 using MRCI and approximate Cl methods 期刊论文  OAI收割 SCIENCE IN CHINA SERIES B-CHEMISTRY, 2007, 卷号: 50, 页码: 614-619 作者:  AnYang, Ll;  Yubin, Wang;  YuSheng, Dou;  ZhenYi, Wen   |  收藏  |  浏览/下载：15/0  |  提交时间：2018/05/31 C-2  MRCI  potential energy curves  non-parallelilty errors   Effect of C-C-C bond bending vibration on the photodissociation of cyclobutane 期刊论文  OAI收割 APPLIED SURFACE SCIENCE, 2007, 卷号: 253, 页码: 6400-6403 作者:  Dou, Yusheng;  Lei, Yibo;  Wen, Zhenyi;  Wang, Yubin;  Lo, Glenn V.   |  收藏  |  浏览/下载：17/0  |  提交时间：2018/05/31 photodissociation  cyclobutane  potential energy surface  tetramethylene diradical  semiclassical dynamics simulation