| CO adsorption on Ag nanoclusters supported on carbon nanotube: a molecular dynamics study H Akbarzadeh, H Yaghoubi, AN Shamkhali, F Taherkhani The Journal of Physical Chemistry C 118 (17), 9187-9195, 2014 | 55 | 2014 |
| The role of nano-sized manganese oxides in the oxygen-evolution reactions by manganese complexes: towards a complete picture MM Najafpour, M Hołyńska, AN Shamkhali, SH Kazemi, W Hillier, E Amini, ... Dalton Transactions 43 (34), 13122-13135, 2014 | 49 | 2014 |
| Effects of gas adsorption on the graphite-supported Ag nanoclusters: a molecular dynamics study H Akbarzadeh, H Yaghoubi, AN Shamkhali, F Taherkhani The Journal of Physical Chemistry C 117 (49), 26287-26294, 2013 | 43 | 2013 |
| A novel barbituric acid-based azo dye and its derived polyamides: Synthesis, spectroscopic investigation and computational calculations MR Zamanloo, A nasser Shamkhali, M Alizadeh, Y Mansoori, ... Dyes and pigments 95 (3), 587-599, 2012 | 39 | 2012 |
| Delivery of cisplatin anti-cancer drug from carbon, boron nitride, and silicon carbide nanotubes forced by Ag-nanowire: a comprehensive molecular dynamics study E Mehrjouei, H Akbarzadeh, AN Shamkhali, M Abbaspour, S Salemi, ... Molecular pharmaceutics 14 (7), 2273-2284, 2017 | 34 | 2017 |
| Polycarbonate surface cell's adhesion examination after Nd: YAG laser irradiation AR SA, SA Mousavi, E Seyedjafari, R Poursalehi, S Sareh, K Silakhori, ... Materials Science and Engineering: C 29 (4), 1491-1497, 2009 | 33 | 2009 |
| A Ca 2+ selective membrane electrode based on calcium-imprinted polymeric nanoparticles T Alizadeh, AN Shamkhali, Y Hanifehpour, SW Joo New Journal of Chemistry 40 (10), 8479-8487, 2016 | 31 | 2016 |
| Au@Void@Ag Yolk–Shell Nanoclusters Visited by Molecular Dynamics Simulation: The Effects of Structural Factors on Thermodynamic Stability H Akbarzadeh, E Mehrjouei, AN Shamkhali Journal of Physical Chemistry Letters 8, 2990–2998, 2017 | 27 | 2017 |
| Synthesis, characterization, DFT studies and catalytic activities of manganese (II) complex with 1, 4-bis (2, 2′: 6, 2′′-terpyridin-4′-yl) benzene MM Najafpour, W Hillier, AN Shamkhali, M Amini, K Beckmann, Z Jagličić, ... Dalton Transactions 41 (39), 12282-12288, 2012 | 27 | 2012 |
| Au@ void@ AgAu yolk–shell nanoparticles with dominant strain effects: a molecular dynamics simulation H Akbarzadeh, E Mehrjouei, AN Shamkhali, M Abbaspour, S Salemi, ... The Journal of Physical Chemistry Letters 8 (20), 5064-5068, 2017 | 26 | 2017 |
| Electrochemical and DFT studies of 8-hydroxyquinoline as corrosion inhibitor for AZ61 magnesium alloy in acidic media D Seifzadeh, S Hamzedoust-Hasankiadeh, AN Shamkhali Prot. Met. Phys. Chem. Surf 49, 229-239, 2013 | 26 | 2013 |
| Ag–Au bimetallic nanoclusters formed from a homogeneous gas phase: a new thermodynamic expression confirmed by molecular dynamics simulation H Akbarzadeh, AN Shamkhali, E Mehrjouei Physical Chemistry Chemical Physics 19 (5), 3763-3769, 2017 | 25 | 2017 |
| Photo-physical behaviors of various active forms of curcumin in polar and low polar environments MK Sadigh, MS Zakerhamidi, AN Shamkhali, E Babaei Journal of Photochemistry and Photobiology A: Chemistry 348, 188-198, 2017 | 23 | 2017 |
| H2 adsorption on Ag‐nanocluster/single‐walled carbon nanotube composites: A molecular dynamics study on the effects of nanocluster size, diameter, and chirality of nanotube H Akbarzadeh, AN Shamkhali Journal of computational chemistry, 2015 | 22 | 2015 |
| New mononuclear manganese (II) complexes with 2, 4, 6-tris (2-pyridyl)-1, 3, 5-triazine (tptz)–selective catalyst in UHP oxidation of sulfides MM Najafpour, M Hołyńska, AN Shamkhali, M Amini, SH Kazemi, ... Polyhedron 34 (1), 202-209, 2012 | 22 | 2012 |
| New molecular insights into the stability of Ni–Pd hollow nanoparticles H Akbarzadeh, E Mehrjouei, AN Shamkhali, M Abbaspour, S Salemi, ... Inorganic Chemistry Frontiers 4 (10), 1679-1690, 2017 | 21 | 2017 |
| Polar and low polar solvents media effect on dipole moments of some diazo Sudan dyes MS Zakerhamidi, SG Sorkhabi, AN Shamkhali Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 127, 340-348, 2014 | 21 | 2014 |
| Melting behavior of (Pd x Pt 1− x) n nanoclusters confined in single-walled carbon nanotubes: a molecular dynamics investigation on the effects of chirality and diameter of … H Akbarzadeh, AN Shamkhali RSC Advances 5 (30), 23160-23173, 2015 | 20 | 2015 |
| Melting behavior of bimetallic and trimetallic nanoparticles: a review of MD simulation studies H Akbarzadeh, E Mehrjouei, M Abbaspour, AN Shamkhali Topics in Current Chemistry 379 (3), 22, 2021 | 19 | 2021 |
| Improving the optoelectronic efficiency of novel meta-azo dye-sensitized TiO2 semiconductor for DSSCs B Seyednoruziyan, MR Zamanloo, AN Shamkhali, T Alizadeh, S Noruzi, ... Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 247, 119143, 2021 | 19 | 2021 |
