国家/地区 Usa（2）
关键词 MOLECULAR DYNAMIC（2）
出版物 JOURNAL OF COMPUTATIONAL CHEMISTRY（2）
出版时间
机构
作者

Development of non-bonded interaction parameters between graphene and water using particle swarm optimization

JOURNAL OF COMPUTATIONAL CHEMISTRY

BEJAGAM KK, SINGH S, DESHMUKH SA

The effect of time step, thermostat, and strain rate on ReaxFF simulations of mechanical failure in diamond, graphene, and carbon nanotube

JOURNAL OF COMPUTATIONAL CHEMISTRY

JENSEN BD, WISE KE, ODEGARD GM