Molecular dynamics and quantum simulation of different cationic dyes removal from contaminated water using UiO-66 (Zr)-(COOH)2 metal–organic framework
Feng Li, Jiajun Liu, Nidal H. Abu‐Hamdeh, Smain Bezzina, Rahime Eshaghi Malekshah
Topics & Concepts
ChemistryHOMO/LUMOCationic polymerizationAdsorptionCrystal violetElectronegativityMoleculeMolecular orbitalInorganic chemistryPhysical chemistryOrganic chemistryPathologyMedicineMetal-Organic Frameworks: Synthesis and ApplicationsX-ray Diffraction in CrystallographyThermal and Kinetic Analysis