ReaxFF Reactive Force Field for Solid Oxide Fuel Cell Systems with Application to Oxygen Ion Transport in Yttria-Stabilized Zirconia
van Duin, Adri C. T., Merinov, Boris V., Jang, Seung Soon, Goddard, William A.Volume:
112
Language:
english
Journal:
The Journal of Physical Chemistry A
DOI:
10.1021/jp076775c
Date:
April, 2008
File:
PDF, 434 KB
english, 2008