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浏览/检索结果: 共123条，第1-10条 帮助

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Numerical realization of a two-dimensional potential energy surface with randomly distributed Gaussian roughness 期刊论文  OAI收割
PHYSICA A-STATISTICAL MECHANICS AND ITS APPLICATIONS, 2025, 卷号: 678, 页码: 7
作者:  Zhao, Pengchen;  Wang, Chunyang;  Zhao, Zengxuan;  Li, Junhua;  Nyasulu, Joelous Malamula
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Vibrational Energy Transfer in CO+N-2 Collisions: A Database for V-V and V-T/R Quantum-Classical Rate Coefficients 期刊论文  OAI收割
MOLECULES, 2021, 卷号: 26, 期号: 23, 页码: 27
作者:  Hong, Qizhen;  Bartolomei, Massimiliano;  Coletti, Cecilia;  Lombardi, Andrea;  Sun, Quanhua
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Physically inspired atom-centered symmetry functions for the construction of high dimensional neural network potential energy surfaces 期刊论文  OAI收割
COMPUTATIONAL MATERIALS SCIENCE, 2021, 卷号: 186, 页码: 7
作者:  Zhang, Kangyu;  Yin, Lichang
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Reconsider the fluorescence properties of 5-ASA and its sensing mechanism for iodide ion 期刊论文  OAI收割
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2019, 卷号: 223, 页码: 8
作者:  Liu, Lei;  Sun, Bingqing;  Pen, Jiancheng;  Mao, Yueyuan;  Ding, Ran
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An ab initio-based global potential energy surface for the SH3 system and full-dimensional state-to-state quantum dynamics study for the H-2 + HS -> H2S + H reaction 期刊论文  OAI收割
JOURNAL OF COMPUTATIONAL CHEMISTRY, 2019, 卷号: 40, 期号: 10, 页码: 1151-1160
作者:  Liu, Shu;  Xu, Xin;  Chen, Jun;  Zhang, Dong H.
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An ab initio-based global potential energy surface for the sh3 system and full-dimensional state-to-state quantum dynamics study for the h-2 + hs -> h2s + h reaction 期刊论文  iSwitch采集
Journal of computational chemistry, 2019, 卷号: 40, 期号: 10, 页码: 1151-1160
作者:  Xu, Xin;  Chen, Jun;  Liu, Shu;  Zhang, Dong H.
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Excited state hydrogen bond and proton transfer mechanism for (2-hydroxy-4-methoxyphenyl)(phenyl)-methanone azine: A theoretical investigation 期刊论文  OAI收割
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2019, 卷号: 210, 页码: 159-164
作者:  Song, Xiaoyan;  Zhang, Tianjie;  Zhang, Qiaoli;  Yang, Dapeng;  Yang, Guang
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Excited state hydrogen bond and proton transfer mechanism for (2-hydroxy-4-methoxyphenyl)(phenyl)-methanone azine: a theoretical investigation 期刊论文  iSwitch采集
Spectrochimica acta part a-molecular and biomolecular spectroscopy, 2019, 卷号: 210, 页码: 159-164
作者:  Yang, Dapeng;  Yang, Guang;  Jia, Min;  Song, Xiaoyan;  Zhang, Qiaoli
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A new potential energy surface of the LiHO+ system and the dynamics studies of the O + LiH+ reaction 期刊论文  OAI收割
CHEMICAL PHYSICS LETTERS, 2019, 卷号: 715, 页码: 123-128
作者:  Wang, Meishan;  He, Di;  Zhang, Tianqi;  Yuan, Jiuchuan
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A new potential energy surface of the liho+ system and the dynamics studies of the o + lih+ reaction 期刊论文  iSwitch采集
Chemical physics letters, 2019, 卷号: 715, 页码: 123-128
作者:  He, Di;  Zhang, Tianqi;  Yuan, Jiuchuan;  Wang, Meishan
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