لطیفی, عباس

پژوهشگاه شیمی و مهندسی شیمی ایران و سازمان صنایع دفاع

[ 1 ] - شبیه‌سازی تجزیه RDX از طریق برهم کنش با موج شوک با استفاده از دینامیک مولکولی

Cylotrimethylenetrinitramine (RDX), with the chemical formula C3H6N6O6, is an energetic organic molecule used widely in commodities of explosives. Its partial stimulation results in decomposition reaction at very high rate. Molecular dynamic technique and LAMMPS code with ReaxFF-lg were employed to simulate initiation of RDX. Potential energy variations of the system were calculated for five di...