검색결과 : 4건
| No. | Article |
|---|---|
| 1 |
Test of trajectory surface hopping against accurate quantum dynamics for an electronically nonadiabatic chemical reaction Topaler MS, Allison TC, Schwenke DW, Truhlar DG Journal of Physical Chemistry A, 102(10), 1666, 1998 |
| 2 |
Method for Quasi-Classical Trajectory Calculations on Potential-Energy Surfaces Defined from Gradients and Hessians, and Model to Constrain the Energy in Vibrational-Modes Varandas AJ, Marques JM Journal of Chemical Physics, 100(3), 1908, 1994 |
| 3 |
Accurate Quantum Calculations for H-2+oh-)H2O+h - Reaction Probabilities, Cross-Sections, and Rate Constants Zhang DH, Zhang JZ Journal of Chemical Physics, 100(4), 2697, 1994 |
| 4 |
Quantum-Mechanical Calculations of the Rate-Constant for the H-2+oh-)H+h2O Reaction - Full-Dimensional Results and Comparison to Reduced Dimensionality Models Manthe U, Seideman T, Miller WH Journal of Chemical Physics, 101(6), 4759, 1994 |