Effects of surface orientations of Cr2O3 on CO2 adsorption: A DFT approach
Anand Kumar, F. Ropital, Theodorus de Bruin, Boubakar Diawara
Topics & Concepts
AdsorptionMoleculeDensity functional theoryChemistryContext (archaeology)Atom (system on chip)Ionic bondingCarboxylateCovalent bondPhysical chemistrySupercritical fluidComputational chemistryChemical physicsIonOrganic chemistryEmbedded systemComputer scienceBiologyPaleontologyPhase Equilibria and ThermodynamicsCarbon dioxide utilization in catalysisCatalysis and Oxidation Reactions