A computational strategy in consideration of the crystal surface structures for the crystal morphology prediction of energetic material
Chongchong She, Kun Chen, Shaohua Jin, Lijie Li, Shusen Chen, Huanmin Liu, Wei Liu, Fang Bao
Topics & Concepts
van der Waals forceAdsorptionCrystal (programming language)Hydrogen bondSolventMorphology (biology)MoleculeCrystal structureSurface energyChemistryCrystallographySurface (topology)Chemical physicsMaterials scienceComputational chemistryPhysical chemistryOrganic chemistryGeometryMathematicsComputer scienceBiologyGeneticsProgramming languageEnergetic Materials and CombustionCrystallization and Solubility StudiesThermal and Kinetic Analysis