Tahar Abbaz

Molecular Structure, HOMO-LUMO, MEP and Fukui Function Analysis of Some TTF-donor Substituted Molecules Using DFT (B3LYP) Calculations

A. Bendjeddou, Tahar Abbaz, Abdelkrim Gouasmia et al. · International Research Journal of Pure and Applied Chemistry · 2016 · 109 citations

Natural Sciences, Chemistry, Physics +10

Molecular structure, HOMO, LUMO, MEP, natural bond orbital analysis of benzo and anthraquinodimethane derivatives

Tahar Abbaz, Amel Bendjeddou, Didier Villemin · Pharmaceutical and Biological Evaluations · 2018 · 44 citations · Full text

Natural Sciences, Chemistry, Medicinal Chemistry +17

Quadratic Nonlinear Optical Response in Partially Charged Donor-Substituted Tetrathiafulvalene:  From a Computational Investigation to a Rational Synthetic Feasibility

Jean François Lamère, Isabelle Malfant, Alix Sournia‐Saquet et al. · Chemistry of Materials · 2007 · 37 citations

Natural Sciences, Chemistry, Physics +16

Quantum Chemical Studies on Molecular Structure and Reactivity Descriptors of Some P-Nitrophenyl-tetrathiafulvalenes by Density Functional theory (DFT)

Amel Bendjeddou, Tahar Abbaz, Abdelkrim Gouasmia et al. · Acta Chimica and Pharmaceutica Indica · 2016 · 22 citations

Natural Sciences, Chemistry, Organic Chemistry +16

A computational study of the inclusion of β-cyclodextrin and nicotinic acid: DFT, DFT-D, NPA, NBO, QTAIM, and NCI-RDG studies

Houdhaifa R. Belhouchet, Tahar Abbaz, Amel Bendjedou et al. · Journal of Molecular Modeling · 2022 · 20 citations · Full text

Natural Sciences, Biochemistry, Chemistry +12