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Frozen Gaussian series representation of the imaginary time propagator theory and numerical tests 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2009, 卷号: 131, 期号: 4, 页码: 044116-1-044116-9
Authors:  Zhang, Dong H.;  Shao, Jiushu;  Pollak, Eli;  Eli Pollak
Favorite  |  View/Download:122/0  |  Submit date:2010/11/30
Boltzmann Equation  Convergence  Gaussian Processes  Iterative Methods  Mathematical Operators  Matrix Algebra  Quantum Theory  Tunnelling  
Comparison of second-order split operator and Chebyshev propagator in wave packet based state-to-state reactive scattering calculations 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2009, 卷号: 130, 期号: 17, 页码: 174102-1-174102- 11
Authors:  Sun, Zhigang;  Lee, Soo-Y.;  Guo, Hua;  Zhang, Dong H.;  Guo H(郭华);  Zhang DH(张东辉)
Favorite  |  View/Download:159/0  |  Submit date:2010/11/30
Chebyshev Approximation  Deuterium  Fluorine  Hydrogen  Hydrogen Compounds  Molecule-molecule Reactions  Oxygen  Probability  Reaction Kinetics Theory