Professor Heidar Raissi
Faculty: Science
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Department: Chemistry
Degree: Ph.D |
Papers in Journals
- 121. _,The influence of nicotine on pioglitazone encapsulation into carbon nanotube the investigation of molecular dynamic and density functional theory,Journal of Biomolecular Structure and Dynamics,Vol. 7,pp. 1-15,2016,ISI،JCR،Scopus.
- 122. ,,,,A theoretical study on the structure of 2-amino-1 3 4-thiadiazole and its 5-substituted derivatives in the gas phase water THF and DMSO solutions,Journal of Molecular Liquids,Vol. 203,pp. 137-142,2015,JCR،Scopus.
- 123. _,Structural QTAIM thermodynamic properties bonding aromaticity and NMR analyses of cation interactions of mono and divalent metal cations ( Li Na K Be2,Journal of Theoretical and Computational Chemistry,Vol. 14,No. 6,pp. 1550044-1550076,2015,JCR،Scopus.
- 124. _,The analysis of electronic structures adsorption properties NBO QTAIM and NMR parameters of the adsorbed hydrogen sulfide on various sites of the outer surface of aluminum phosphide nanotube a DFT study,Structural Chemistry,Vol. 26,pp. 1059-1075,2015,JCR،Scopus.
- 125. _,Investigation of adsorption properties of CS2 on interior and exterior surfaces of single-walled silicon-carbide nanotubes and effect of applied electric field electronic structure charge density and NMR studies,RSC Advances,Vol. 5,pp. 84022-84037,2015,ISI،JCR،Scopus.
- 126. _,Effects of the HCN adsorption on the structural and electronic parameters of the beryllium oxide nanotube,Structural Chemistry,Vol. 1,pp. 1-15,2015,JCR،Scopus.
- 127. _,Quantum chemical study on influence of the substitution effect on the structural and electronic properties and intramolecular hydrogen bonding of 2-nitrophenyl hydrosulfide in ground and electronic excited state,Structural Chemistry,Vol. 26,pp. 971-987,2015,JCR،Scopus.
- 128. ,,The hybrid of Pd and SWCNT (Pd loaded on SWCNT) as an efficient sensor for the formaldehyde molecule detection A DFT study,Sensors and Actuators B: Chemical,Vol. 212,pp. 55-62,2015,ISI،JCR،Scopus.
- 129. Maasoumeh Jafarpour,A DFT investigation of axial N-donor ligands effects on the high valent manganese-oxo meso-tetraphenyl porphyrin,Journal of Porphyrins and Phthalocyanines,Vol. 19,pp. 651-662,2015,JCR،Scopus.
- 130. Maasoumeh Jafarpour,Stereoelectronic effects of porphyrin ligand on the oxygen transfer efficiency of high valent manganese-oxo porphyrin species A DFT study,Journal of Porphyrins and Phthalocyanines,Vol. 19,pp. 1130-1139,2015,JCR،Scopus.
- 131. Maasoumeh Jafarpour,Significant hydrogen-bonding effect on the reactivity of high-valent manganese(V) oxo porphyrins in C H bond activation A DFT study,Journal of Porphyrins and Phthalocyanines,Vol. 19,pp. 1197-1203,2015,JCR،Scopus.
- 132. ,,Molecular structure and bonding character of mono and divalent metal cations (Li Na K Be2 Mg2 and Ca2 ) with substituted benzene derivatives AIM NBO and NMR analyses,Structural Chemistry,Vol. 25,pp. 1327-1342,2014,JCR،Scopus.
- 133. Mohammad ali Nasseri,Ali Allahresani,Grafting of a chiral Mn(iii) complex on graphene oxide nanosheets and its catalytic activity for alkene epoxidation,RSC Advances,Vol. 4,pp. 26087-26094,2014,ISI،JCR،Scopus.
- 134. Mohammad ali Nasseri,Ali Allahresani,Mild oxidation of alkenes catalyzed by Fe3O4/SiO2 nanoparticles,Reaction Kinetics, Mechanisms and Catalysis,Vol. 112,pp. 397-408,2014,JCR،Scopus.
- 135. _,Molecular structure conformational stability energetic and intramolecular hydrogen bonding in ground and electronic excited state of 3-mercapto propeneselenal,Structural Chemistry,Vol. 25,pp. 1153-1164,2014,JCR،Scopus.
- 136. _,Theoretical study of substituents effects on characteristics of resonance-assisted hydrogen bond in (Z)-(thionitrosomethylene)hydrazine and its derivatives in ground and electronic excited state,Structural Chemistry,Vol. 25,pp. 1099-1109,2014,JCR،Scopus.
- 137. _,Immunosuppressive agent leflunomide A SWNTs-immobilized dihydroortate dehydrogenase inhibitory effect and computational study of its adsorption properties on zigzag single walled (6 0) carbon and boron nitride nanotubes as controlled drug delivery devices,European Journal of Pharmaceutical Sciences,Vol. 56,pp. 37-54,2014,JCR،Scopus.
- 138. _,Comprehensive study of the structural and electronic properties of complexes formed by M z (Li Na K Be 2 Mg 2,Journal of Sulfur Chemistry,Vol. 36,pp. 48-66,2014,JCR،Scopus.
- 139. _,Electronic structures intramolecular hydrogen bond interaction and aromaticity of substituted 4-amino-3-penten-2-one in ground and electronic excited state,Structural Chemistry,Vol. 25,No. 6,pp. 505-505,2014,JCR،Scopus.
- 140. Mohammad ali Nasseri,Ali Allahresani,A new application of nano-graphene oxide as a heterogeneous catalyst in crossed,Iranian Journal of Catalysis,Vol. 4,No. 1,pp. 33-40,2014,isc،Scopus.
Showing 121-140 of 175 items.