التفاصيل البيبلوغرافية
العنوان: |
Quasiclassical dynamics of benzene overtone relaxation on an ab initio force field. I. Energy.... |
المؤلفون: |
Minehardt, Todd J., Wyatt, Robert E. |
المصدر: |
Journal of Chemical Physics; 11/15/1998, Vol. 109 Issue 19, p8330, 8p, 4 Charts, 8 Graphs |
مصطلحات موضوعية: |
BENZENE, TRAJECTORY optimization, CELESTIAL reference systems, HAMILTONIAN systems |
مستخلص: |
Examines planar benzene overtone relaxation through quassiclassical trajectories computation. Description of the coordinate system, Hamiltonian and force field models; Conditions of trajectory simulation; Results of energy flow and survival probabilities calculation. |
قاعدة البيانات: |
Complementary Index |