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[会议论文] 作者：Daiqian Xie,
来源：第十一届全国量子化学会议 年份：2011
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[会议论文] 作者：Daiqian Xie,
来源：第十一届全国化学动力学会议 年份：2009
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[会议论文] 作者：Daiqian Xie,
来源：2015国际分子生物物理学前沿研讨会暨2015计算化学国际前沿研讨会 年份：2015
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Path Integral Monte Carlo Simulations on the Structures and Spectroscopic Properties of van der Waal
[会议论文] 作者：Daiqian Xie,
来源：第三届全国计算原子与分子物理学术会议 年份：2010
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[会议论文] 作者：Daiqian Xie,
来源：2013年第十三届全国化学动力学会议 年份：2013
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[会议论文] 作者：Daiqian Xie,
来源：第14届全国化学动力学会议 年份：2015
Recently,we developed a new set of non-adiabatically coupled potential energy surfaces for the lowest three electronic states of H2O at the internally contracte...
[会议论文] 作者：Daiqian Xie,
来源：第十三届全国量子化学会议 年份：2017
The state-to-state dynamics is a highly sought-after observable for photodissociation because it provides the most detailed information for dynamics.While photo...
Potential energy surfaces,spectroscopy,and dynamics of the NH2 system.Importance of the Renner-Telle
[会议论文] 作者：Daiqian Xie,
来源：中国化学会第二十七届学术年会 年份：2010
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[会议论文] 作者：Anyang Li,Daiqian Xie,
来源：第十一届全国量子化学会议 年份：2011
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[会议论文] 作者：Anyang Li,Daiqian Xie,
来源：第十一届全国量子化学会议 年份：2011
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[会议论文] 作者：Guang-shuang-mu Lin,Daiqian Xie,
来源：第十五届全国化学动力学会议 年份：2017
Aromatic molecules with dissociative X-H(X=N,O,S,etc)stretch coordinate always hold a conical intersection between the repulsive electronic excited state and ground state along the X-H vibr ational mo...
Peptide Bond trans-cis Isomerisation and Acylimine Formation in Chromophore Maturation of the Red Fl
[会议论文] 作者：Xuefeng Ren,Daiqian Xie,Jun Zeng,
来源：第十一届全国量子化学会议 年份：2011
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State-to-state quantum dynamics of the H+HBr reaction:Competition between the abstraction and exchan
[会议论文] 作者：Changjian Xie,Bin Jiang,Daiqian Xie,
来源：第十一届全国量子化学会议 年份：2011
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Pathways for methanol steam reforming involving adsorbed formaldehydeand hydroxyl intermediates on C
[会议论文] 作者：Sen Lin,Daiqian Xie,Hua Guo,
来源：第十一届全国量子化学会议 年份：2011
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Construction of Potential Energy Surface for ClH2O System and Its Application in Ring Polymer Molecu
[会议论文] 作者：Junxiang Zuo,Hua Guo,Daiqian Xie,
来源：第十五届全国化学动力学会议 年份：2017
A new and more accurate full-dimensional global permutation invariant polynomial-neural network(PIP-NN)potential energy surface(PES)for the ground electroni...
[会议论文] 作者：Yongle Li,Hua Guo,Daiqian Xie,
来源：第十五届全国化学动力学会议 年份：2017
The determination of chemical reaction coefficients plays central role in the chemical kinetics modeling of combustion,atmospheric and interstellar chemistry by...
State-to-state quantum dynamics of the H+HBr reaction:Competition between the abstraction and exchan
[会议论文] 作者：Changjian Xie,Bin Jiang,Daiqian Xie,
来源：第十一届全国量子化学会议 年份：2011
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[会议论文] 作者：Changjian Xie,Daiqian Xie,Hua Guo,
来源：第十二届全国量子化学会议 年份：2014
Ammonia has long been regarded as a prototype for non-adiabatic dynamics in polyatomic systems and its A-band photodissociation has been involved many interesting issues,such as tunneling,non-adiabati...
A theoretical study for the state-to-state photodissociation dynamics of the vibrationally excited w
[会议论文] 作者：Guang-Shuang-Mu Lin,Linsen Zhou,Daiqian Xie,
来源：第十二届全国量子化学会议 年份：2014
Based on a recent high-level ab initio potential energy surfaces,the state-to-state photodissociation dynamics from the initial vibrationally excited H2O in its second absorption band has been investi...
Construction of Potential Energy Surface for ClH2O System and Its Application in Ring Polymer Molecu
[会议论文] 作者：Junxiang Zuo,Hua Guo,Daiqian Xie,
来源：第十五届全国化学动力学会议 年份：2017
A new and more accurate full-dimensional global permutation invariant polynomial-neural network(PIP-NN)potential energy surface(PES)for the ground electronic state of the ClH2O system is developed by...
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