| 1 |
Six-dimensional quantum dynamics study for the dissociative adsorption of DCl on Au(111) surface
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期刊论文 |
Tianhui Liu|Bina Fu|Dong H. Zhang| |
| 2 |
Six-dimensional potential energy surface of the dissociative chemisorption of Hcl on Au(111) using neural networks
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期刊论文 |
Liu Tianhui|Fu Bina|Zhang Dong H.| |
| 3 |
Trapped Abstraction in the O(D-1) + CHD3 -> OH + CD3 Reaction
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期刊论文 |
Shuai, Quan|Fu, Bina|Zhang, Dong H.|Yang, Xueming| |
| 4 |
Analysis of Potential Energy Surface for Butanone Isomerization
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期刊论文 |
Hai-feng Xu|Rui-han Zhu|Mei-xia Zhang|Da-jun Ding| |
| 5 |
Communication: On the competition between adiabatic and nonadiabatic dynamics in vibrationally mediated ammonia photodissociation in its A band
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期刊论文 |
Jianyi Ma|David R. Yarkony|Daiqian Xie|Hua Guo| |
| 6 |
Communication: Separable potential energy surfaces from multiplicative artificial neural networks
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期刊论文 |
Koch, Werner|Zhang, Dong H.| |
| 7 |
Low temperature rate constants for the N(S-4) + CH(X-2 Pi(r)) reaction. Implications for N-2 formation cycles in dense interstellar clouds
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期刊论文 |
Wakelam, Valentine|Xie, Daiqian|Guo, Hua|Hickson, Kevin M.| |
| 8 |
CH4 dissociation on Ni(111): a quantum dynamics study of lattice thermal motion
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期刊论文 |
Xiangjian Shen|Zhaojun Zhang|Dong H. Zhang| |
| 9 |
Validity of the site-averaging approximation for modeling the dissociative chemisorption of H2 on Cu(111) surface: A quantum dynamics study on two potential energy surfaces
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期刊论文 |
Tianhui Liu|Bina Fu|Dong H. Zhang| |
| 10 |
State to State Photodissociation Dynamics of Vibrationally Excited D2O in B Band
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期刊论文 |
Shan-yu Han|Lin-sen Zhou|Dai-qian Xie| |
| 11 |
A local mode picture for H atom reaction with vibrationally excited H2O: a full dimensional stateto-state quantum dynamics investigation
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期刊论文 |
Shu Liu|Dong H. Zhang| |
| 12 |
Theoretical Study of the State-to-State Photodissociation Dynamics of the Vibrationally Excited Water Molecule in the B Band
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期刊论文 |
Guang-Shuang-Mu Lin|Linsen Zhou|Daiqian Xie| |
| 13 |
Ab initio study on the potential energy surfaces of NCO2+
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期刊论文 |
Haifeng Xu|Ruihan Zhu|Meixia Zhang|Dajun Ding| |
| 14 |
Isotope-Dependent Rotational States Distributions Enhanced by Dynamic Resonance States: A Comparison Study of the F plus HD -> HF(V-HF=2) + D and F + H-2 -> HF(V-HF=2) + H Reaction
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期刊论文 |
Long Huang|Dongxu Dai|Xueming Yang|Dong H. Zhang| |
| 15 |
The modified quasi-quantum treatment of rotationally inelastic NO(X)–He scattering
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期刊论文 |
Xia Zhang|Chris J. Eyles|Dajun Ding|Steven Stolte| |
| 16 |
Accurate calculation of the potential energy curve and spectroscopic parameters of X2Σ+ state of 12Mg1H*
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期刊论文 |
Tan Bin|Xie An-Dong|Yan Bing|Ding Da-Jun| |
| 17 |
A permutationally invariant full-dimensional ab initio potential energy surface for the abstraction and exchange channels of the H + CH4 system
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期刊论文 |
Zhiqiang Zhao|Daiqian Xie|Dong H. Zhang|Hua Guo| |
| 18 |
A full-dimensional quantum dynamics study of the mode specificity in the H + HOD abstraction reaction
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期刊论文 |
Bina Fu|Dong H. Zhang| |
| 19 |
Mode specificity in the H + H2O -〉H-2 + OH reaction: A full-dimensional quantum dynamics study
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期刊论文 |
Bina Fu|Dong H. Zhang| |
| 20 |
Electron-Ion Differential Cross Section extracting from the High-order Above-Threshold Ionization spectroscopy of C2H4 and C2H6
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会议论文 |
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| 21 |
Ab initio determination of potential energy surfaces for the first two UV absorption bands of SO2
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期刊论文 |
Xixi Hu|Linsen Zhou|Daiqian Xie|Hua Guo| |
| 22 |
Low temperature rate constants for the N(4S) + CH(X2Pr) reaction. Implications for N2 formation cycles in dense interstellar clouds
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期刊论文 |
Valentine Wakelam|Daiqian Xie|Hua Guo|Kevin M. Hickson| |
| 23 |
Dissociative chemisorption dynamics of small molecules on metal surfaces
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期刊论文 |
Bin Jiang|Daiqian Xie| |
| 24 |
Nonadiabatic laser-induced orientation and alignment of rotational-state-selected CH3Br molecules
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期刊论文 |
Fuchun Liu|Wim G. Roeterdink|Steven Stolte|Dajun Ding| |
| 25 |
Effects of reagent rotational excitation on the H + CHD3 -> H-2 + CD3 reaction: A seven dimensional time-dependent wave packet study
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期刊论文 |
Zhang, Zhaojun|Zhang, Dong H.| |
| 26 |
Vibronic origin of sulfur mass-independent isotope effect in photoexcitation of SO2 and the implications to the early earth's atmosphere
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期刊论文 |
Xixi Hu|Daiqian Xie|Hua Guo|Shuhei Ono| |
| 27 |
Dissociative chemisorption dynamics of small molecules on metal surfaces
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期刊论文 |
Jiang Bin|Xie DaiQian| |
| 28 |
Quasiclassical trajectory studies of O-18(P-3) + NO2 isotope exchange and reaction to O-2 + NO on D-0 and D-1 potentials
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期刊论文 |
Fu, Bina|Zhang, Dong H.|Bowman, Joel M.| |
| 29 |
State-to-state quantum dynamics of the N(4S) + C2(1Σ+) → CN(2Σ+) + C(3P) reaction
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期刊论文 |
Xixi Hu|Changjian Xie|Daiqian Xie| |
| 30 |
Observation of Dynamical Resonances Accessible Only by Reagent Vibrational Exciation in the F+HD-HF+D Reaction
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期刊论文 |
Long Huang|Dongxu Dai|Xueming Yang|Dong. H. Zhang| |
| 31 |
Eight-dimensional quantum reaction rate calculations for the H+CH4 and H2+CH3 reactions on recent potential energy surfaces
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期刊论文 |
Yong Zhou|Dong H. Zhang| |
| 32 |
Global Potential Energy Surface for the H+CH4 H-2+CH3 Reaction using Neural Networks
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期刊论文 |
Xu, Xin|Chen, Jun|Zhang, Dong H.| |
| 33 |
Signatures of non-adiabatic dynamics in the fine-structure state distributions of the OH(？X /？) products in the B-band photodissociation of H2O
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期刊论文 |
Linsen Zhou|Daiqian Xie|Hua Guo| |
| 34 |
Six-dimensional quantum dynamics of dissociative chemisorption of H2 on Co(0001) on an accurate global potential energy surface
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期刊论文 |
Xixi Hu|Sen Lin|Daiqian Xie|Hua Guo| |
| 35 |
Time-Dependent Wave Packet Study of the H2 + CH3 → H + CH4 Reaction
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期刊论文 |
Zhaojun Zhang|Jun Chen|Minghui Yang|Dong H. Zhang| |
| 36 |
Methane dissociation on Ni(111): A fifteen-dimensional potential energy surface using neural network method
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期刊论文 |
Jun Chen|Zhaojun Zhang|Kejie Shao|Donghui Zhang| |
| 37 |
Laser induced alignment of state-selected CH3I
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期刊论文 |
Chunjing Lu|Steven Stolte|Dajun Ding|Wim G. Roeterdink| |
| 38 |
Quantum and quasi-classical dynamics of the OH + CO→H + CO2 reaction on a new permutationally invariant neural network potential energy surface
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期刊论文 |
Jun Li|Jun Chen|Dong H. Zhang|Hua Guo| |
| 39 |
Trapped Abstraction in the O(1D) + CHD3 → OH + CD3 Reaction
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期刊论文 |
Quan Shuai|Bina Fu|Dong H. Zhang|Xueming Yang| |
| 40 |
Full-Dimensional Quantum Dynamics of Vibrationally Mediated Photodissociation of NH3 and ND3 on Coupled Ab Initio Potential Energy Surfaces: Absorption Spectra and NH2(A？2A1)/NH2(X？2B1) Branching Ratios
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期刊论文 |
Xiaolei Zhu|David R. Yarkony|Daiqian Xie|Hua Guo| |
| 41 |
High-Level, First-Principles, Full-Dimensional Quantum Calculation of the Ro-vibrational Spectrum of the Simplest Criegee Intermediate (CH2OO)
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期刊论文 |
J. M. Bowman|R. Dawes|Daiqian Xie|Hua Guo| |
| 42 |
State-to-state quantum versus classical dynamics study of the OH plus CO -> H + CO2 reaction in full dimensions (J=0): checking the validity of the quasi-classical trajectory method
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期刊论文 |
Liu, Shu|Chen, Jun|Fu, Bina|Zhang, Dong H.| |
| 43 |
Six-dimensional quantum dynamics study for the dissociative adsorption of Hcl on Au(111) surface
|
期刊论文 |
Tianhui Liu|Bina Fu|Dong H. Zhang| |
| 44 |
A global potential energy surface for the H-2 + OH -〉H2O + H reaction using neural networks
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期刊论文 |
Chen, Jun|Xu, Xin|Xu, Xin|Zhang, Dong H.| |
| 45 |
Extremely short-lived reaction resonances in Cl+HD(v=1)→DCl+H due to chemical bond softening
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期刊论文 |
Zhigang Sun|Dongxu Dai|Xueming Yang|Dong H. Zhang| |
| 46 |
Communication: A six-dimensional state-to-state quantum dynamics study of the H+CH4 -〉H-2+CH3 reaction (J=0)
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期刊论文 |
Liu, Shu|Chen, Jun|Zhang, Zhaojun|Zhang, Dong H.| |
| 47 |
Ionization/dissociation processes of methyl-substituted derivates of cyclopentanone in intense femtosecond laser field
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期刊论文 |
Sheng Der Chao|Sheng Hsien Lin|O. K. Kosheleva|A. M. Mebel| |
| 48 |
Vibronic origin of sulfur mass-independent isotope effect in photoexcitation of SO2 and the implications to the early earth's atmosphere
|
期刊论文 |
Hu, Xixi|Xie, Daiqian|Guo, Hua|Ono, Shuhei| |
| 49 |
Accuracy of the centrifugal sudden approximation in the H + CHD3 -> H-2 + CD3 reaction
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期刊论文 |
Zhang, Zhaojun|Chen, Jun|Liu, Shu|Zhang, Dong H.| |
| 50 |
Ion–ion coincidence imaging of dissociative ionization dynamics of formic acid in intense laser fields
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期刊论文 |
R. Zhu|G. Prümper|K. Shimada|K. Ueda| |
| 51 |
Communication: An accurate global potential energy surface for the OH plus CO -〉H + CO2 reaction using neural networks
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期刊论文 |
Jun Chen|Xin Xu|Xin Xu|Dong H. Zhang| |
| 52 |
H + H2 quantum dynamics using potential energy surfaces based on the XYG3 type of doubly hybrid density functionals: Validation of the density functionals
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期刊论文 |
Jun Chen|Zhigang Sun|Dong H. Zhang|Xin Xu| |
| 53 |
Full-Dimensional Quantum State-to-State Nonadiabatic Dynamics for Photodissociation of Ammonia in its A-Band
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期刊论文 |
Dong Hui Zhang|David R. Yarkony|Daiqian Xie|Hua Guo,| |
| 54 |
Resonance-like enhancement in high-order above-threshold ionization of formic acid
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期刊论文 |
G. Pr¨umper|K. Shimada|K. Ueda|R. Zhu| |
| 55 |
A general scaling rule for the collision energy dependence of a rotationally inelastic differential cross-section and its application to NO(X) plus He
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期刊论文 |
Chris J. Eyles|Craig A. Taatjes|Dajun Ding|Steven Stolte| |
| 56 |
Six-dimensional potential energy surface of the dissociative chemisorption of HCl on Au(111) using neural networks.
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期刊论文 |
Tianhui Liu|Bina Fu|Dong H. Zhang| |
| 57 |
Hexapole transmission spectrum of formaldehyde oxide
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期刊论文 |
J. Bulthuis|E.P.F. Lee|D. Ding|C.A. Taatjes| |
| 58 |
Communication: On the competition between adiabatic and nonadiabatic dynamics in vibrationally mediated ammonia photodissociation in its A band
|
期刊论文 |
Jianyi Ma|David R. Yarkony|Daiqian Xie|Hua Guo| |
| 59 |
Electron-Ion Differential Cross Section extracting from the High-order Above-Threshold Ionization spectroscopy of C2H4 and C2H6
|
会议论文 |
|
| 60 |
Full-Dimensional Quantum Dynamics of Vibrationally Mediated Photodissociation of NH3 and ND3 on Coupled Ab Initio Potential Energy Surfaces: Absorption Spectra and NH2(A？2A1)/NH2(X？2B1) Branching Ratios
|
期刊论文 |
Xiaolei Zhu|David R. Yarkony|Daiqian Xie|Hua Guo| |
