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Global Potential Energy Surfaces by Compressed-State Multistate Pair-Density Functional Theory for Hyperthermal Collisions in the O2+O2 System 期刊论文
CHEMPHYSCHEM, 2024, 页码: 15
Authors:  Jiang, Jie;  Yang, Jiawei;  Hong QZ(洪启臻);  Sun QH(孙泉华);  Li, Jun
Favorite  |  View/Download：4/0  |  Submit date：2024/05/27
Quantum-classical rate coefficient datasets of vibrational energy transfer in carbon monoxide based on highly accurate potential energy surface 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2024, 卷号: 160, 期号: 8, 页码: 15
Authors:  Hong QZ(洪启臻);  Storchi, Loriano;  Coletti, Cecilia;  Li, Jia;  Sun QH(孙泉华);  Li, Jun
Favorite  |  View/Download：12/0  |  Submit date：2024/05/14
Experimental and numerical studies on the thermal nonequilibrium behaviors of CO with Ar, He, and H2 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2023, 卷号: 159, 期号: 23, 页码: 16
Authors:  He, Dong;  Hong QZ(洪启臻);  Li F(李飞);  Sun QH(孙泉华);  Si, Ting;  Luo XS(罗喜胜)
Adobe PDF(5968Kb)  |  Favorite  |  View/Download：84/8  |  Submit date：2024/01/22
Improved Quantum-Classical Treatment of N2-N2 Inelastic Collisions: Effect of the Potentials and Complete Rate Coefficient Data Sets 期刊论文
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2023, 卷号: 19, 期号: 23, 页码: 8557-8571
Authors:  Hong QZ(洪启臻);  Storchi, Loriano;  Sun QH(孙泉华);  Bartolomei, Massimiliano;  Pirani, Fernando;  Coletti, Cecilia
Adobe PDF(5231Kb)  |  Favorite  |  View/Download：46/6  |  Submit date：2024/01/22
Stochastic simulation of hydrogen-oxygen auto-ignition at the microscale 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2023, 卷号: 159, 期号: 8, 页码: 84105
Authors:  Yang C(杨超);  Hu Y(胡远);  Wang XY(王小永);  Hong QZ(洪启臻);  Sun QH(孙泉华)
Adobe PDF(8545Kb)  |  Favorite  |  View/Download：57/5  |  Submit date：2023/09/26
Inelastic N-2+H-2 collisions and quantum-classical rate coefficients: large datasets and machine learning predictions 期刊论文
EUROPEAN PHYSICAL JOURNAL D, 2023, 卷号: 77, 期号: 7, 页码: 128
Authors:  Hong QZ(洪启臻);  Storchi, Loriano;  Bartolomei, Massimiliano;  Pirani, Fernando;  Sun QH(孙泉华);  Coletti, Cecilia
Adobe PDF(3024Kb)  |  Favorite  |  View/Download：38/1  |  Submit date：2023/09/05
Global and Full-Dimensional Potential Energy Surfaces of the N2+O2 Reaction for Hyperthermal Collisions 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2023
Authors:  Tao, Chun;  Yang, Jiawei;  Hong QZ(洪启臻);  Sun QH(孙泉华);  Li, Jun
Adobe PDF(9381Kb)  |  Favorite  |  View/Download：64/9  |  Submit date：2023/06/15
Vibrational deactivation in O(P-3) + N-2 collisions: from an old problem towards its solution 期刊论文
PLASMA SOURCES SCIENCE & TECHNOLOGY, 2022, 卷号: 31, 期号: 8, 页码: 16
Authors:  Hong QZ(洪启臻);  Bartolomei, Massimiliano;  Pirani, Fernando;  Esposito, Fabrizio;  Sun QH(孙泉华);  Coletti, Cecilia
Adobe PDF(2972Kb)  |  Favorite  |  View/Download：326/46  |  Submit date：2022/09/16
vibrational relaxation  non-adiabatic transitions  N-2 + O collisions  V-T rate coefficients  V-E rate coefficients  
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
MOLECULES, 2021, 卷号: 26, 期号: 23, 页码: 27
Authors:  Hong QZ(洪启臻);  Bartolomei, Massimiliano;  Coletti, Cecilia;  Lombardi, Andrea;  Sun QH(孙泉华);  Pirani, Fernando
Adobe PDF(735Kb)  |  Favorite  |  View/Download：267/18  |  Submit date：2022/03/05
vibrational energy transfer  inelastic scattering  potential energy surface  rate coefficients database  quantum-classical nuclear dynamics  quasi-classical trajectories  
Reconciling experimental and theoretical vibrational deactivation in low-energy O + N-2 collisions 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2021, 卷号: 23, 期号: 29, 页码: 5
Authors:  Hong QZ(洪启臻);  Bartolomei, Massimiliano;  Esposito, Fabrizio;  Coletti, Cecilia;  Sun QH(孙泉华);  Pirani, Fernando
Adobe PDF(3296Kb)  |  Favorite  |  View/Download：496/101  |  Submit date：2021/08/03
vibronic transition