Molecular dynamics simulation of the interaction mechanisms between oxygen-containing functional groups in coal and quartz
Yi Zhu, Fanfei Min, Bao Ren, Hui Li
Topics & Concepts
Molecular dynamicsQuartzCoalDynamics (music)OxygenDensity functional theoryChemical physicsChemistryMaterials scienceComputational chemistryPsychologyOrganic chemistryMetallurgyPedagogyCoal Properties and UtilizationMethane Hydrates and Related PhenomenaGeotechnical and Geomechanical Engineering