Towards a mathematical understanding of surface hopping methods

来源 :2016数学青年学者论坛(2016 Young Mathematician Forum) | 被引量 : 0次 | 上传用户:daney_he
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  We develop a surface hopping algorithm based on frozen Gaussian approximation for semiclassical matrix Schr(o)dinger equations.The algorithm is asymptotically derived from the Schr(o)dinger equation with rigorous approximation error analysis.The resulting algorithm can be viewed as a path integral stochastic representation of the semiclassical matrix Schr(o)dinger equations.
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