Publications
Ab initio insights into the coordination and spodium bonds of group 12-bearing molecules
Pristine and Pt-doped RuC nanosheets as urea and thiourea sensors: DFT-based insights
DFT insights into RuC nanosheet as an adsorption platform for biogas molecule
Extensive DFT analysis of Rb2XTlCl6 (X = Al, K) double perovskites: Exploring potential for thermoelectric and optoelectronic applications
Sigma-hole site-based interactions of Aerogen-containing molecules with simultaneous Lewis bases: an ab-initio study
Development of Green-Assessed and Highly Sensitive Spectrophotometric Methods for Ultra-Low-Level Nitrite Determination Using Rhodanine and 7-Hydroxycoumarin in Environmental Samples
Synthesis, spectral, thermal, and biological characterization of Se (IV) nanocomplexes derived from vitamin E and amino acid mixed ligands as a metal-drug model
Hydration characteristics of cement blended with thermally reactivated recycled concrete demolition waste
Fluoride-Based Halide Double Perovskites X2BiAuF6 (X = K, Rb): A Computational Insight into their Structural Integrity, Optoelectronic Performance, and Thermoelectric Potential
Hydration properties of belite cement prepared by limehydrothermal treatment of Saudi basaltic volcanic ash and glass
Covalent Binding of Sodium Dodecyl Sulfate as C12 Hydrocarbon Chain to Silica Coated Magnetite Under Microwave Irradiation for Removal and Enrichment of Brilliant Green Dye Spiked Environmental Water Samples
New method based on solid-phase extraction and ultra high-performance liquid chromatography-fluorescence detector for the trace level detection of safranin and rhodamine B dyes in kid's candies
Ab initio investigation for π-hole interactions of tetrel- and aerogen-bearing molecules with multiple CO Lewis bases
Preparation of lanthanum and nickel complexes based on a newly prepared Schiff base ligand: Structural elucidation, molecular docking, and density functional theory calculations
Computational Exploration of Structural, Elastic, Optoelectronic and Magnetic Properties of A2YHgCl6 (A = Cs, K) Using Enhanced Computational Techniques
Investigation of spin polarized semiconductor Cs2XMoBr6 (X= Li, Na) compounds for spintronic and optoelectronic applications
Norfloxacin Fluorescent Probe for the Assessment of Cefepime in Biological Fluids and Pharmaceutical Formulation; Investigation of the Greenness and Blueness Characteristics
Sensitivity of pure and Ni-decorated boron nitride B12N12 nanocages toward CH4, H2S, and N2 biogases: A DFT study
A theoretical study on symmetrical non-fullerene electron acceptors molecules on BDTPT based derivatives to enhance photovoltaic properties of organic solar cells
Insights for Precursors Influence on the Solar-Assisted Photocatalysis of Greenly Synthesizing Zinc Oxide NPs towards Fast and Durable Wastewater Detoxification
One-Pot Phyto-Mediated Synthesis of Fe2O3/Fe3O4 Binary Mixed Nanocomposite Efficiently Applied in Wastewater Remediation by Photo-Fenton Reaction
Microwave assisted facile green synthesis of silica coated magnetite nanoparticles for fast removal of Methylene blue dye from environmental water samples
Development of an RP-HPLC Method for Quantifying Diclofenac Diethylamine, Methyl Salicylate, and Capsaicin in Pharmaceutical Formulation and Skin Samples
Green Synthesis of Uncoated and Olive Leaf Extract-Coated Silver Nanoparticles: Sunlight Photocatalytic, Antiparasitic, and Antifungal Activities
Adsorption of Molnupiravir anti-COVID-19 drug over B12N12 and Al12N12 nanocarriers: a DFT study
Towards Development of High-performance Perovskite Solar cells based on Pyrrole Materials for Hole Transport Layer by using Computational Approach
A DFT study for improving the photovoltaic performance of organicsolar cells by designing symmetric non-fullerene acceptors by quantumchemical modification on pre-existed LC81 molecule
Strategies towards end-group engineering of chrysene core based non-fullerene acceptors for high performance organic solar cells: A DFT study
Adsorption of Cr(VI) using ?-Fe2O3 coated hydroxy magnesium silicate (HMS): isotherm, thermodynamic and kinetic study
Simultaneous green TLC determination of nirmatrelvir and ritonavir in the pharmaceutical dosage form and spiked human plasma
Adsorption of Molnupiravir anti-COVID-19 drug over B N and Al N nanocarriers: a DFT study
Effects of Lewis Basicity and Acidity on σ-Hole Interactions in Carbon-Bearing Complexes: A Comparative Ab Initio Study
Adsorption of Chlormethine Anti-Cancer Drug on Pure and Aluminum-Doped Boron Nitride Nanocarriers: A Comparative DFT Study