Cu2O/WO3: A promising S-scheme heterojunction for photocatalyzed degradation of carbamazepine and reduction of nitrobenzene

Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density

Chengteh Lee, Weitao Yang, Robert G. Parr · Physical review. B, Condensed matter · 1988 · 100.1K citations

Natural Sciences, Chemistry, Physics +17

Density-functional thermochemistry. I. The effect of the exchange-only gradient correction

Axel D. Becke · The Journal of Chemical Physics · 1992 · 3.9K citations

Natural Sciences, Chemistry, Physics +17

S-Scheme Heterojunction Photocatalyst

Quanlong Xu, Liuyang Zhang, Bei Cheng et al. · Chem · 2020 · 3.7K citations · Full text

Energy-adjusted <i>a</i> <i>b</i> <i>i</i> <i>n</i> <i>i</i> <i>t</i> <i>i</i> <i>o</i> pseudopotentials for the first row transition elements

Michael Dolg, Ulrich Wedig, Hermann Stoll · The Journal of Chemical Physics · 1987 · 3.5K citations

Natural Sciences, Chemistry, Computational Chemistry +16

Engineering heterogeneous semiconductors for solar water splitting

Xin Li, Jiaguo Yu, Jingxiang Low et al. · Journal of Materials Chemistry A · 2014 · 1.9K citations

Engineering, Chemical Engineering, Materials Science +17