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CORC

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Thermal rate coefficients and kinetic isotope effects of the reaction HO + H2O -> H2O + OH 期刊论文
THEORETICAL CHEMISTRY ACCOUNTS, 2019, 卷号: 138, 期号: 9, 页码: 7
作者:  Zhu, Yongfa;  Lu, Yunpeng;  Song, Hongwei
收藏  |  浏览/下载：52/0  |  提交时间：2019/12/06
Non-adiabatic state-to-state dynamic studies of Na(3p) + H-2(nu=1, 2, 3; j=0) -> NaH plus H reactions 期刊论文
CHEMICAL PHYSICS LETTERS, 2019, 卷号: 723, 页码: 128-132
作者:  Buren, Bayaer;  Yang, Zijiang;  Chen, Maodu
收藏  |  浏览/下载：9/0  |  提交时间：2019/12/02
Non-adiabatic quantum dynamical studies of Na(3p) + HD(nu=1, j=0)-> NaH/NaD plus D/H reaction 期刊论文
CHINESE PHYSICS B, 2019, 卷号: 28
作者:  Wen, Yue-Pei;  Buren, Bayaer;  Chen, Mao-Du
收藏  |  浏览/下载：4/0  |  提交时间：2019/12/02
On the mechanism of non-radiative decay of blue fluorescent protein chromophore: New insight from the excited-state molecular dynamics simulations and potential energy calculations 期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2017, 卷号: 186, 页码: 52-58
作者:  Zhao, Li;  Liu, Jian-Yong;  Zhou, Pan-Wang
收藏  |  浏览/下载：20/0  |  提交时间：2017/12/20
On the mechanism of non-radiative decay of blue fluorescent protein chromophore: New insight from the excited-state molecular dynamics simulations and potential energy calculations 期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2017, 卷号: 186, 页码: 52-58
作者:  Zhao, Li;  Liu, Jian-Yong;  Zhou, Pan-Wang
收藏  |  浏览/下载：21/0  |  提交时间：2017/12/20
Breakdown of the vibrationally adiabatic approximation in the early-barrier CH3 + HBr -> CH4 + Br reaction 期刊论文
THEORETICAL CHEMISTRY ACCOUNTS, 2017, 卷号: 136, 期号: 5
作者:  Song, Hongwei;  Ping, Leilei;  Wang, Yan;  Yang, Minghui
收藏  |  浏览/下载：13/0  |  提交时间：2017/12/06
Ab initio conical intersections for the Si(D-1) + H-2 reaction system: a lowest five singlet states study 期刊论文
RSC ADVANCES, 2017, 卷号: 7, 期号: 20, 页码: 12074-12084
作者:  Wu, Yanan;  Zhang, Chunfang;  Ma, Haitao
收藏  |  浏览/下载：14/0  |  提交时间：2018/01/12
合成气输送床甲烷化催化剂与工艺研究 学位论文
博士, 北京: 中国科学院研究生院, 2016
作者:  崔佃淼
收藏  |  浏览/下载：56/0  |  提交时间：2017/09/08
Non-adiabatic dynamics simulation exploration of the wavelength-dependent photoinduced relaxation mechanism of trans-N-1-methyl-2-(tolylazo) imidazole in the gas phase 期刊论文
RSC ADVANCES, 2016, 卷号: 6, 期号: 69, 页码: 64323-64331
作者:  Zhao, Li;  Zhou, Pan-Wang;  Zhao, Guang-Jiu
收藏  |  浏览/下载：14/0  |  提交时间：2019/06/20
Non-adiabatic dynamics simulation exploration of the wavelength-dependent photoinduced relaxation mechanism of trans-n-1-methyl-2-(tolylazo) imidazole in the gas phase 期刊论文
Rsc advances, 2016, 卷号: 6, 期号: 69, 页码: 64323-64331
作者:  Zhao, Li;  Zhou, Pan-Wang;  Zhao, Guang-Jiu
收藏  |  浏览/下载：16/0  |  提交时间：2019/05/09

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