Unveiling the power of defect engineering in MOF-808 to enhance efficient carbon dioxide adsorption and separation by harnessing the potential of DFT analysis
Amir Kazemi, Mahyar Ashourzadeh Pordsari, Mohsen Tamtaji, Mohammad Hossein Afshari, Saber Keshavarz, Fateme Zeinali, Hasan Baesmat, Shahla Zahiri, Faranak Manteghi, Ahad Ghaemi, Sohrab Rohani, William A. Goddard
Topics & Concepts
Carbon dioxideAdsorptionChemical engineeringChemistryMaterials scienceProcess engineeringEngineeringOrganic chemistryMetal-Organic Frameworks: Synthesis and ApplicationsCarbon Dioxide Capture TechnologiesMachine Learning in Materials Science