Michael Badawi
0000-0002-3504-4180
University of Lorraine
10 papers found
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Microstructure, adsorption site energetics, and formation enthalpy control for FAU-Zeolite Cs+ exchange
Incorporating solvent effects in DFT: insights from cation exchange in faujasites
Enhanced adsorption of ketoprofen and 2,4-dichlorophenoxyactic acid on Physalis peruviana fruit residue functionalized with H2SO4: Adsorption properties and statistical physics modeling
Assessing the Accuracy of Machine Learning Thermodynamic Perturbation Theory: Density Functional Theory and Beyond
One-step fabrication of a new outstanding rutile TiO2 nanoparticles/anthracite adsorbent: Modeling and physicochemical interpretations for malachite green removal
Understanding the adsorption mechanism of Ag+ and Hg2+ on functionalized layered double hydroxide via statistical physics modeling
Physicochemical interpretation of the adsorption of 4-Bromophenol and 4-Chloroaniline on an activated carbon
Quantum Effects on the Diffusivity of Hydrogen Isotopes in Zeolites
Benchmarking the performance of approximate van der Waals methods for the structural and energetic properties of SiO2 and AlPO4 frameworks
Comparative study of structural and electronic properties of GaSe and InSe polytypes
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