otropic :

Tiago S Domingues1, Ronald Coifman2,3, Amir Haji-Akbari1

  • 1Department of Chemical and Environmental Engineering, Yale University, New Haven, Connecticut 06520, United States.

概括

由于物理的变化,在封闭条件下估计材料的扩散性具有挑战性. 本综述调查了从分子动力学模拟中计算扩散性概况的方法.