Short time expansion of the relative motion of molecular pairs. Application to water
Alberto De Santis; Alessandro Ercoli; Dario Rocca
Журнал:
Journal of Physics: Condensed Matter
Дата:
2000-06-19
Аннотация:
A detailed analysis of the short time expansion of the relative mean square displacement and mean square distance of pairs is performed for molecular fluids. A theoretical expression which relates the t<sup>2</sup> coefficient of the expansion to the local structure of the fluid is obtained. Good agreement between theoretical predictions and simulated data is found in the case of supercooled water.
92.42Кб