Pressure-transmitting boundary conditions for molecular-dynamics simulations
Author/Authors :
Schنfer، نويسنده , , Carsten and Urbassek، نويسنده , , Herbert M. and Zhigilei، نويسنده , , Leonid V. and Garrison، نويسنده , , Barbara J.، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2002
Pages :
9
From page :
421
To page :
429
Abstract :
A scheme for establishing boundary conditions in molecular-dynamics simulations that prevent pressure wave reflection out of the simulation volume is formulated. The algorithm is easily implemented for a one-dimensional geometry. Its efficiency is tested for compressive waves in Cu.
