Molecular dynamics simulation on the crystal morphology of β-HMX affected by binary and ternary solvent systems
Yuanfang Cheng, Chongchong She, Meizhuang Qiao, Shaohua Jin, Shusen Chen, Lijie Li, Kun Chen
Topics & Concepts
Propylene carbonateTernary operationvan der Waals forceSolventHydrogen bondChemistryCrystal (programming language)Molecular dynamicsDimethyl sulfoxideMoleculeAdsorptionPhysical chemistryComputational chemistryOrganic chemistryComputer scienceElectrochemistryProgramming languageElectrodeEnergetic Materials and CombustionCrystallography and molecular interactionsCrystallization and Solubility Studies