论文信息 - Comparison of close coupling and quasiclassical trajectory calculations for rotational energy transfer in the collision of two HF molecules on a realistic potential energy surface - 字舞流文

Comparison of close coupling and quasiclassical trajectory calculations for rotational energy transfer in the collision of two HF molecules on a realistic potential energy surface

We report rigid‐rotator close coupling calculations and quasiclassical trajectory calculations for HF–HF collisions with total angular momentum zero. The results are compared to test the trajectory method.

M. Coltrin | D. Truhlar | D. Schwenke

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