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Ca-decorated MoBOH as a promising adsorbent for CH2O, C6H6, C3H6O, and C2HCl3 removal at room temperature: A first-principle study

Deqiao Li, Xianfei Chen, Chaozhu Shu, Yi Huang, Peicong Zhang, Beibei Xiao, Dan Zhou

2021Applied Surface Science22 citationsDOI

Topics & Concepts

AdsorptionDesorptionMonolayerDensity functional theoryChemistryMoleculeChemical engineeringMaterials scienceOrganic chemistryComputational chemistryEngineeringBiochemistryCovalent Organic Framework ApplicationsAdvanced Photocatalysis TechniquesMetal-Organic Frameworks: Synthesis and Applications
Ca-decorated MoBOH as a promising adsorbent for CH2O, C6H6, C3H6O, and C2HCl3 removal at room temperature: A first-principle study | Litcius