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Theoretical studies on the potentials of some nanocages (Al12N12, Al12P12, B12N12, Be12O12, C12Si12, Mg12O12 and C24) on the detection and adsorption of Tabun molecule: DFT and TD-DFT study
Stochastic QoE-Aware Optimization in Cloud-Based Content Delivery Networks
The effect of agarose content on the morphology phase evolution and magnetic properties of CoFe 2 O 4 nanoparticles prepared by sol-gel autocombustion method
Color Centers in Hexagonal Boron Nitride Monolayers A Group Theory and Ab Initio Analysis
A single chemosensor with combined ionophore/fluorophore moieties acting as a fluorescent Off-On Zn2 sensor and a colorimetric sensor for Cu2 Experimental logic gate behavior and TD-DFT calculations
A single chemosensor with combined ionophore/fluorophore moieties acting as a fluorescent Off-On Zn2 sensor and a colorimetric sensor for Cu2 Experimental logic gate behavior and TD-DFT calculations
A single chemosensor with combined ionophore/fluorophore moieties acting as a fluorescent Off-On Zn2 sensor and a colorimetric sensor for Cu2 Experimental logic gate behavior and TD-DFT calculations
DFT NBO and molecular docking studies of the adsorption of fluoxetine into and on the surface of simple and sulfur-doped carbon nanotubes
Description of adenine and cytosine on Au(111) nano surface using different DFT functionals (PW91PW91 wB97XD M06-2X M06-L and CAM-B3LYP) in the framework of ONIOM scheme Non0periodic calculations
Essential oil composition total phenolic and flavonoid contents and antioxidant activity of Thymus species collected from different regions of Iran
Essential oil composition total phenolic and flavonoid contents and antioxidant activity of Thymus species collected from different regions of Iran
An efficient finite difference time domain algorithm for band structure calculations of Phononic crystal
Calculated structural and electronic interactions of the nano dye molecule Ru(4 4 -COOH - 2 2 - bpy)2(NCS)2( N3) with a iodide/triiodide redox shuttle
Calculated structural and electronic interactions of the nano dye molecule Ru(4 4 -COOH - 2 2 - bpy)2(NCS)2( N3) with a iodide/triiodide redox shuttle
Calculated structural and electronic interactions of the nano dye molecule Ru(4 4 -COOH - 2 2 - bpy)2(NCS)2( N3) with a iodide/triiodide redox shuttle