Surface Science · 2024 · 10 citations · 46 references
EngineeringChemical EngineeringEnvironmental EngineeringEnvironmental RemediationWastewater TreatmentWater TreatmentHeavy Metal RemediationHeavy Metal RemovalIron OxidesAdsorption Of ArsenicArsenate SorptionArsenic RemediationArsenic RemovalNanomaterial-based SorbentsSorbent MaterialsSynergistic Impacts
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Generalized Gradient Approximation Made Simple
John P. Perdew, Kieron Burke, Matthias Ernzerhof · Physical Review Letters · 1996 · 211.5K citations · Full text
Natural Sciences, Chemistry, Physics +16
From molecules to solids with the DMol3 approach
B. Delley · The Journal of Chemical Physics · 2000 · 10.9K citations · Full text
Natural Sciences, Chemistry, Physics +12
Hardness conserving semilocal pseudopotentials
B. Delley · Physical review. B, Condensed matter · 2002 · 1.8K citations · Full text