Crystal growth, morphological, mechanical, spectroscopic studies, optical properties, molecular docking, ADME/T, Hirshfeld surfaces analysis and theoretical calculations of hybrid organic-inorganic phosphate compound
Abdellatif Rafik, Burak Tüzün, Hafid Zouihri, Lahcen El Ammari, Zaki Safi, Nuha Wazzan, Taoufiq Guedira
Topics & Concepts
ChemistryCrystallographyNatural bond orbitalDensity functional theoryMolecular orbitalCrystal structureCrystal (programming language)Single crystalHOMO/LUMOMoleculeComputational chemistryOrganic chemistryProgramming languageComputer scienceCrystallography and molecular interactionsNonlinear Optical Materials ResearchChemical Thermodynamics and Molecular Structure