Design, characterization, and adsorption properties of Padina gymnospora/zeolite nanocomposite for Congo red dye removal from wastewater

From molecules to solids with the DMol3 approach

B. Delley · The Journal of Chemical Physics · 2000 · 10.7K citations · Full text

Engineering, Theoretical Inorganic Chemistry, Dmol3 Approach +20

An all-electron numerical method for solving the local density functional for polyatomic molecules

B. Delley · The Journal of Chemical Physics · 1990 · 10.3K citations · Full text

Numerical Analysis, Engineering, Ritz Variation Method +19

Kinetics of Adsorption on Carbon from Solution

Walter J. Weber, John C. Morris · Journal of the Sanitary Engineering Division · 1963 · 9.4K citations

Pore Size Distribution, Engineering, Bio-based Sorbent +17

Re-epithelialization and immune cell behaviour in an ex vivo human skin model

Ana Rakita, Nenad Nikolić, Michael Mildner et al. · Scientific Reports · 2020 · 8.1K citations · Full text

<i>Understanding Molecular Simulation: From Algorithms to Applications</i>

Daan Frenkel, Berend Smit, Mark A. Ratner · Physics Today · 1997 · 5.1K citations

Computer Simulators, Engineering, Physics +11