Brief CV
Hadi Behzadi
Associate Professor of Physical Chemistry
Department of Physical Chemistry, Faculty of Chemistry, Kharazmi University, Tehran, Iran
Date of Birth: Nov., 1, 1975
Place of Birth: Amol, North of Iran
Nationality: Iranian
Living Country: Iran
Material Status: Married,
Contact Information:
Email: behzadi@khu.ac.ir, behzadihadi@yahoo.com
Phone: 0912 424 7671- (+98) 26 34551023
Educational Background:
2008, Ph.D in Physical Chemistry, Department of Chemistry, Tarbiat Modares University, Tehran,Iran
First Supervisor:
Nasser L. Hadipour
Adders: Department of Chemistry, Tarbiat Modares UniVersity, P.O. Box 14115-175, Tehran, Iran
Tel: (+98) 21 82883495 (Room No. 603)
Email: hadipour_n@yahoo.com and hadipour@modares.ac.ir
Second Supervisor:
G.A. Parsafar
Adders: Department of Chemistry, Sharif University of Technology, Tehran, Iran
Tel.: +98 21 66165355; fax: +98 21 600 5718.
Email: Parsafar@Sharif.edu
1998-2000, M.Sc Student of Physical Chemistry, Department of Chemistry, Mazandaran
University, Babolsar, Iran
1994-1998, B.Sc Student of Chemistry, Department of Chemistry, Guilan University, Rasht, Iran
Course subjects taught:
General Chemistry, Physical Chemistry I and II, Physical Chemistry Lab I and II, Molecular Spectroscopy, Quantum Chemistry, Advanced Quantum Chemistry, Theoretical chemistry of nanostructures, Advanced Physical Chemistry, Computational Chemistry, New Subject in Physical Chemistry
Research interests
Nanostructures, Corrosion inhibitor, Drug Design, Aromaticity
Foreign research
Summer 2007(3 month): Visiting Scientist at Department of Cell and Molecular Biology, Uppsala
University
Summer 2018 (2 month): Visiting Scientist at Department of Physical and Organic Chemistry
Jožef Stefan Institute, Slovenia

List of Publications:
1. Hajiahmadi, Z.; Tavangar, Z.; Behzadi, H., A DFT Study of the Reaction between Benzopyrene Epoxide and C60 Derivatives as Possible Anticancer Activity. Polycyclic Aromatic Compounds 2019, 1-11.
2. Farahati, R.; Ghaffarinejad, A.; Mousavi-Khoshdel, S. M.; Rezania, J.; Behzadi, H.; Shockravi, A., Synthesis and potential applications of some thiazoles as corrosion inhibitor of copper in 1 M HCl: Experimental and theoretical studies. Progress in Organic Coatings 2019, 132, 417-428.
3. Van Duong, L.; Matito, E.; Solà, M.; Behzadi, H.; Momeni, M. J.; Nguyen, M. T., The electronic structure and stability of germanium tubes Ge 30 H 12 and Ge 33 H 12. Physical Chemistry Chemical Physics 2018, 20 (36), 23467-23479.
4. Rezania, J.; Behzadi, H.; Shockravi, A.; Ehsani, M.; Akbarzadeh, E., Synthesis and DFT calculations of some 2-aminothiazoles. Journal of Molecular Structure 2018, 1157, 300-305.
5. Behzadi, H.; Manzetti, S.; Dargahi, M.; Roonasi, P.; Khalilnia, Z., Application of calculated NMR parameters, aromaticity indices and wavefunction properties for evaluation of corrosion inhibition efficiency of pyrazine inhibitors. Journal of Molecular Structure 2018, 1151, 34-40.
6. Behzadi, H.; Forghani, A., Correlation between electronic parameters and corrosion inhibition of benzothiazole derivatives-NMR parameters as important and neglected descriptors. Journal of Molecular Structure 2017, 1131, 163-170.
7. Behzadi, H., Aromatic-like behavior of germanium nanocrystals. RSC Advances 2016, 6 (53), 47434-47442.
8. Momeni, M. J.; Behzadi, H.; Roonasi, P.; Sadjadi, S. A. S.; Mousavi-Khoshdel, S. M.; Mousavi, S. V., Ab initio study of two quinoline derivatives as corrosion inhibitor in acidic media: electronic structure, inhibitor–metal interaction, and nuclear quadrupole resonance parameters. Research on Chemical Intermediates 2015, 41 (9), 6789-6802.
9. Manzetti, S.; Lu, T.; Behzadi, H.; Estrafili, M. D.; Le, H.-L. T.; Vach, H., Intriguing properties of unusual silicon nanocrystals. RSC Advances 2015, 5 (95), 78192-78208.
10. Behzadi, H.; Roonasi, P.; van der Spoel, D.; Manzetti, S., Relationship between electronic properties and drug activity of seven quinoxaline compounds: A DFT study. Journal of Molecular Structure 2015, 1091, 196-202.
11. Behzadi, H.; Roonasi, P.; Momeni, M. J.; Manzetti, S.; Esrafili, M. D.; Obot, I.; Yousefvand, M.; Mousavi-Khoshdel, S. M., A DFT study of pyrazine derivatives and their Fe complexes in corrosion inhibition process. Journal of Molecular Structure 2015, 1086, 64-72.
12. Halimehjani, A. Z.; Shakourian-Fard, M.; Farvardin, M. V.; Raeesi, M.; Hashemi, M. M.; Behzadi, H., Design and synthesis of new family of ionic liquids based on 2-iminium-1, 3-dithiolanes: A combined theoretical and experimental effort. Journal of Molecular Structure 2014, 1056, 56-62.
13. Dadmehr, M.; Hosseini, M.; Hosseinkhani, S.; Ganjali, M.; Khoobi, M.; Behzadi, H.; Hamedani, M.; Sheikhnejad, R., DNA methylation detection by a novel fluorimetric nanobiosensor for early cancer diagnosis. Biosensors and Bioelectronics 2014, 60, 35-44.
14. Behzadi, H.; Esrafili, M. D.; Manzetti, S.; Roonasi, P., A density functional study of silicon fullerene endohedral X@ Si20F20 and exohedral X-Si20F20 (X= O2−, S2−, Se2−) complexes. Physica E: Low-dimensional Systems and Nanostructures 2014, 56, 69-73.
15. Vakili, M.; Eshghi, H.; Raeisian, M.; Afzali, R.; Berenji, A. R.; Behzadi, H., Structure and isomeric studies of 1, 3-diaryl-H-benzo [f] chromene, catalyst effect or thermodynamic stability? An ab initio study. Iranian Journal of Catalysis 2013, 3 (3), 139-147.
16. Shockravi, A.; Kamali, M.; Behzadi, H.; Pahlavan Moghanlo, S.; Nategholeslam, M., Synthesis and Template Studies of New Aza Macrocycles and one Cryptand Based on 2, 6-diaminopyridine and its Computational NMR Studies Using Density Functional Theory. Letters in Organic Chemistry 2013, 10 (4),
256-262.
17. Sergio, M.; Behzadi, H.; Otto, A.; van der Spoel, D., Fullerenes toxicity and electronic properties. Environmental chemistry letters 2013, 11 (2), 105-118.
18. Mahdaviani, A.; Esrafili, M. D.; Esrafili, A.; Behzadi, H., A quantum chemistry study on surface reactivity of pristine and carbon-substituted AlN nanotubes. Physica E: Low-dimensional Systems and Nanostructures 2013, 53, 161-167.
19. Esrafili, M. D.; Behzadi, H., A comparative study on carbon, boron-nitride, boron-phosphide and silicon-carbide nanotubes based on surface electrostatic potentials and average local ionization energies. Journal of molecular modeling 2013, 19 (6), 2375-2382.
20. Esrafili, M. D.; Behzadi, H., A DFT study on carbon-doping at different sites of (8, 0) boron nitride nanotube. Structural Chemistry 2013, 24 (2), 573-581.
21. Esrafili, M. D.; Behzadi, H., Investigation into the nature of interactions in aspirin–water clusters including SAPT, AIM and NBO theories. Molecular Simulation 2013, 39 (8), 629-639.
22. Esrafili, M. D.; Behzadi, H., A theoretical study on H-bonding interactions in maleic acid: calculated 17O, 1H NMR parameters and QTAIM analysis. Molecular Simulation 2012, 38 (11), 896-905.
23. Karami, L.; Behzadi, H.; Hadipour, N. L.; Mousavi-Khoshdel, M., Study of C= O center dot center dot center dot HN Hydrogen bond interactions in amyloid beta (A beta): A DFT study of the electric field gradient and CS tensors and NBO analysis. COMPUTATIONAL AND THEORETICAL CHEMISTRY 2011, 965
(1), 137-145.
24. Behzadi, H.; Olyai, M. R. T. B.; van der Spoel, D., Probing 13 C chemical shielding tensors in cryptolepine and two bromo-substituted analogs for antiplasmodial activity. Journal of molecular modeling 2011, 17 (12), 3289-3297.
25. Beheshtian, J.; Behzadi, H.; Esrafili, M. D.; Shirvani, B. B.; Hadipour, N. L., A computational study of water adsorption on boron nitride nanotube. Structural Chemistry 2010, 21 (5), 903-908.
26. Behzadi, H.; Esrafili, M. D.; Beheshtian, J.; Hadipour, N. L.; van der Spoel, D., A density functional study of 15N chemical shielding tensors in quinolines. Chemical Physics Letters 2009, 476 (4- 6), 196-200.
27. Esrafili, M. D.; Behzadi, H.; Hadipour, N. L., Theoretical study of N–H··· O hydrogen bonding properties and cooperativity effects in linear acetamide clusters. Theoretical Chemistry Accounts 2008, 121 (3-4), 135-146.
28. Esrafili, M. D.; Behzadi, H.; Hadipour, N. L., 14N and 17O electric field gradient tensors in benzamide clusters: theoretical evidence for cooperative and electronic delocalization effects in N–H⋯O hydrogen bonding. Chemical Physics 2008, 348 (1-3), 175-180.
29. Esrafili, M. D.; Behzadi, H.; Hadipour, N. L., Density functional theory study of N–H⋯ O, O–H⋯ O and C–H⋯ O hydrogen-bonding effects on the 14N and 2H nuclear quadrupole coupling tensors of Nacetyl-valine. Biophysical chemistry 2008, 133 (1-3), 11-18.
30. Esrafili, M. D.; Behzadi, H.; Beheshtian, J.; Hadipour, N. L., Theoretical 14N nuclear quadrupole resonance parameters for sulfa drugs: Sulfamerazine and sulfathiazole. Journal of Molecular Graphics and Modelling 2008, 27 (3), 326-331.
31. Behzadi, H.; van der Spoel, D.; Esrafili, M. D.; Parsafar, G. A.; Hadipour, N. L., Role of spin state on the geometry and nuclear quadrupole resonance parameters in hemin complex. Biophysical chemistry 2008, 134 (3), 200-206.
32. Behzadi, H.; Esrafili, M. D.; Hadipour, N. L.; Parsafar, G., A theoretical study of repeating sequence in HRP II: A combination of molecular dynamics simulations and 17O quadrupole coupling tensors. Biophysical chemistry 2008, 137 (2-3), 76-80.
33. Esrafili, M. D.; Behzadi, H.; Hadipour, N. L., Influence of N–H… O and O–H… O hydrogen bonds on the 17O, 15N and 13C chemical shielding tensors in crystalline acetaminophen: A density functional theory study. Biophysical chemistry 2007, 128 (1), 38-45.
34. Behzadi, H.; Hadipour, N. L.; Mirzaei, M., A density functional study of 17O, 14N and 2H electric field gradient tensors in the real crystalline structure of α-glycine. Biophysical chemistry 2007, 125 (1),179-183.
35. Behzadi, H.; Esrafili, M. D.; Hadipour, N. L., A theoretical study of 17O, 14N and 2H nuclear quadrupole coupling tensors in the real crystalline structure of acetaminophen. Chemical physics 2007, 333 (2-3), 97-104.
Educational records
#
Course
University
City
Country
Graduation Date
Total mean
1
B.Sc
Guilan University
Rasht
Iran
1997
2
M.Sc
Mazandaran University
Tehran
Iran
2000
3
Ph.D
Tarbiat Modarres University
Tehran
Iran
2008