화학공학소재연구정보센터
검색결과 : 3건
No. Article
1 Molecular modeling of energetic materials: The parameterization and validation of nitrate esters in the COMPASS force field
Bunte SW, Sun H
Journal of Physical Chemistry B, 104(11), 2477, 2000
2 COMPASS : An ab initio force-field optimized for condensed-phase applications - Overview with details on alkane and benzene compounds
Sun H
Journal of Physical Chemistry B, 102(38), 7338, 1998
3 Ab-Initio Calculations and Force-Field Development for Computer-Simulation of Polysilanes
Sun H
Macromolecules, 28(3), 701, 1995