A DFT, AIM and NBO study of isoniazid drug delivery by MgO nanocage I Ravaei, M Haghighat, SM Azami Applied Surface Science 469, 103-112, 2019 | 53 | 2019 |
Dry mechanochemical conversion of SrSO4 to SrCO3 N Setoudeh, NJ Welham, SM Azami Journal of Alloys and Compounds 492 (1-2), 389-391, 2010 | 37 | 2010 |
Spin–orbit interaction effects on the optical rectification of a cubic quantum dot B Vaseghi, G Rezaei, V Azizi, SM Azami Physica E: Low-dimensional Systems and Nanostructures 44 (7-8), 1241-1243, 2012 | 23 | 2012 |
Nature of closed‐and open‐shell interactions between noble metals and rare gas atoms Z Jamshidi, K Eskandari, SM Azami International Journal of Quantum Chemistry 113 (16), 1981-1991, 2013 | 21 | 2013 |
Electron density based characterization of π bonds in planar molecules SM Azami The Journal of Physical Chemistry A 114 (43), 11794-11797, 2010 | 15 | 2010 |
Local σ–π mixing in C60 buckminsterfullerene SM Azami, R Pooladi, MH Sheikhi Journal of Molecular Structure: THEOCHEM 901 (1-3), 153-156, 2009 | 13 | 2009 |
Encapsulation of glycine inside C60 fullerene: Impact of confinement M Shahamirian, SM Azami Physics Letters A 383 (36), 126004, 2019 | 12 | 2019 |
Orbital representation of kinetic energy pressure S Fakhraee, SM Azami The Journal of chemical physics 130 (8), 2009 | 12 | 2009 |
Decomposition of deformation density into orbital components AH Pakiari, S Fakhraee, SM Azami International Journal of Quantum Chemistry 108 (3), 415-422, 2008 | 11 | 2008 |
Electronic states and nonlinear optical properties of a two‐dimensional hexagonal quantum dot: Effects of impurity, geometrical size and confinement potential G Rezaei, SM Azami, B Vaseghi physica status solidi (b) 249 (7), 1459-1464, 2012 | 9 | 2012 |
Topological analysis of steric and relaxation deformation densities F Ghanavati, SM Azami Molecular Physics 115 (6), 743-756, 2017 | 7 | 2017 |
Coherent superposition of resonance wave function in terms of weighted orthogonalized natural localized configurations AH Pakiari, SM Azami International Journal of Quantum Chemistry 108 (2), 219-228, 2008 | 7 | 2008 |
Electron Density Analysis of Hyperconjugation SM Azami ChemPhysChem 16 (18), 3842-3845, 2015 | 5 | 2015 |
Multicenter bond index analysis of influence of metal cations on the aromaticity of aromatic amino acids: Phenylalanine and tyrosine AH Pakiari, M Farrokhnia, SM Azami Chemical Physics Letters 457 (1-3), 211-215, 2008 | 5 | 2008 |
Electronic structure and nonlinear optical properties of a two-dimensional hexagonal quantum dot SM Azami, G Rezaei, B Vaseghi Physica B: Condensed Matter 407 (5), 907-911, 2012 | 4 | 2012 |
Strong intramolecular hydrogen bonding in confined amino acids M Shahamirian, SM Azami Journal of Molecular Graphics and Modelling 106, 107913, 2021 | 3 | 2021 |
Density functional theory computation of the intermolecular interactions of Al 2@ C 24 and Al 2@ Mg 12 O 12 semiconducting quantum dots conjugated with the glycine tripeptide H Mohammadi, SM Azami, H Rafii-Tabar RSC advances 13 (15), 9824-9837, 2023 | 2 | 2023 |
Block deformation analysis: Density matrix blocks as intramolecular deformation density I Ravaei, SM Azami Journal of Computational Chemistry 41 (29), 2446-2458, 2020 | 2 | 2020 |
DFT Study of the Interaction of Trialkylamines with -Clusters L Pakdel, T Sedghamiz, SM Azami Arabian Journal for Science and Engineering 44 (1), 199-208, 2019 | 2 | 2019 |
Local angular momentum as ring strain descriptor SM Azami, M Kheirmand, G Rezaei International Journal of Quantum Chemistry 112 (14), 2623-2626, 2012 | 2 | 2012 |