Articles

Journal Papers
Title DOI Date type
Molecular design of carbazole-based dyes and the influence of alkyl substituent on the performance of dye-sensitized solar cells # Journal
Density Functional Theory of Tautomerism and Water-Assisted Proton Transfer of Glycoluril1 # Journal
Adsorption of some important tautomers of 5-amino tetrazole on the (001) and (101) surfaces of anatase Theoretical study # Journal
Production of 5-hydroxymethylfurfural from fructose using a spherically fibrous KCC-1 silica catalyst # Journal
One pot synthesis of ethyl 3 aryl 2 (1H tetrazol 5 yl) acrylates and 3 (1H tetrazol 5 yl) coumarins via tandem 2 3 dipolar cycloaddition reaction Knoevenagel condensation # Journal
Theoretical Studies on the Adsorption of 5-Aminotetrazole on Single-walled Carbon Nanotubes # Journal
A comparative MP2 study between water- and acid-assisted proton transfer allophanic acid as a case of study # Journal
A DFT approach for simple and solvent assisted-proton movement Biurea as a case of study # Journal
Enantiomeric discrimination of leucine enantiomers by nanotubular cyclic peptides DFT and ONIOM calculation of the absorption spectra of guested enantiomers # Journal
Theoretical study of microhydrated cyclo(L-pro)4-alkali cation complexes # Journal
The catalytic conversion of fructose into 5-hydroxymethylfurfural over acid-functionalized KIT-6 an ordered mesoporous silica # Journal
Comparing the ion affinity of two ionophores Theoretical study of alkali earth metal ion nano tubular cyclic peptide complexes # Journal
Amino-functionalized mesoporous silica as solid base catalyst for regioselective aza-Michael reaction of aryl tetrazoles # Journal
Application of amine-functionalized MCM-41 as pH-sensitive nano container for controlled release of 2-mercaptobenzoxazole corrosion inhibitor # Journal
The effect of deformation and intermolecular interaction on the absorption spectrum of 5-aminotetrazole and hydrazine A computational molecular spectroscopy study on hydrazinium 5-aminotetrazolate # Journal
Selective Complexation of S-block Cations with Nanotubular Silk Type Cyclopeptides A DFT Study # Journal
A DFT-D study on the interaction between lactic acid and single-wall carbon nanotubes # Journal
Synthesis and characterization of organic dyes bearing new electron-withdrawing group for dye-sensitized solar cells # Journal
New tetrazole-based organic dyes for dye-sensitized solar cells # Journal
Preparation characterization degradation and biocompatibility of different silk fibroin based composite scaffolds prepared by freeze-drying method for tissue engineering application # Journal