دکتر مريم دهستاني

انتشارات

مقاله های مجله

1. B. Lashkari; M. Dehestani; A. Khosravan; M. Dehestani, Investigation of Molecular Selenium ‎Adsorption to the Outer Surface of Single ‎Wall Carbon Nanotubes

International Journal of Nanoscience and Nanotechnology, 13, 2, 129-137, 2017

2. L Zeidabadinejad, M Dehestani, S Pourestarabadi, On the chemical bonding features in palladium containing compounds: A combined QTAIM/DFT topological analysis

Journal of Structural Chemistry, 58, 3, 471-478, 2017

3. M Dehestani, L Zeidabadinejad, S Pourestarabadi, QTAIM investigations of decorated graphyne and boron nitride for Li detection

J. Serb. Chem. Soc., 82, 3, 289-301, 2017

4. Ehsan Faghih-Mirzaee, Maryam Dehestani, Leila Zeidabadinejad, Computational study on transfer of L-ascorbic acid by UlaA through Escherichia coli membrane

Journal of Bioinformatics and Computational Biology, 15, 1750007, 2017

5. M. Dehestani, S. Pourestarabadi, L. Zeidabadinejad,, Quantum Chemical Investigation on the Structural and Electronic Properties of α, β and γ-cyclodextrin Complexes: DFT and QTAIM Analysis

Russian Journal of Physical Chemistry A, 90, 6, 1200–1207, 2016

6. Leila Zeidabadinejad and Maryam Dehestani, Effects of Displacement–Distortion of Potential Energy Surfaces on Nonadiabatic Electron Transfers via Conical Intersections: Application to SO2 and trans-1,3,5-Hexatriene

Journal of Physical Chemistry A, 120, 26, 4431-4446, 2016

7. M Dehestani, L Zeidabadinejad, S Pourestarabadi, Density Functional Theory Calculation on Improving the Photocatalytic Properties of Zinc Oxide and Cadmium Sulfide by Hybridization with Metal-Organic Framework

Journal of Advanced Materials in Engineering (Esteghlal), 34, 4, 107-113, 2016

8. M. Dehestani, R. Naghizadeh, F. Shojaie, Theoretical investigation of Mechanism and Kinetics of the CH3NH2+O(3P) Reaction

Reaction, Progress in Reaction Kinetics and Mechanism, Progress in Reaction Kinetics and echanism, 40, 3, 249-260, 2015

9. N. Mohaghegh, L. Zeidabadi, M. Tasviri, M. Dehestani, MR. Gholami, - ,A joint exprimental and theoretical study on ZnO nanocomposities, synthesised by a liquid deposition method, progress in reaction kinetics and mechanism4), ().

Progress in Reaction Kinetics and Mechanism, 40, 3, 261-278, 2015

10. M. Dehestani, L. Zeidabadi, QTAIM investigation of bis(pyrazol-1-yl)methane derivative and its Zn(II) complexes (ZnLX2, X = Cl, Br or I)

Journal of the Serbian Chemical Society, 40, 1-15, 2015

11. L Zeidabadinejad, M Dehestani, A theoretical study of the structural, vibrational, and topological properties of charge distribution of the molecular complexes between furan and zeolites

Scientia Iranica. Transaction C, Chemistry, Chemical Engineering, 22, 6, 2262, 2015

12. M. Dehestani, R. Sharafdini, Analysis of the Photoelectron Spectra of Selenium Difluoride and Selenium Dichloride Based on Franck-Condon Factors

Spectroscopy Letters, 47, 657-663, 2014

13. M. Amiri , M. Eftekhari, M. Dehestani, A. Tajaddini, Modeling intermolecular potential of He–F2 dimer from symmetry-adapted perturbation theory using multi-gene genetic programming), .

Scientia Iranica, 20, 3, 543-548, 2013

14. L. Zeidabadinejad, M. Dehestani, "Theoretical study of the structureal, vibrational and topological properties of the charge distribution of the molecular molecular complexes between furan and zeolites

Scientia Iranica, 20, 3, 543-548, 2013

15. M. Dehestani, Z. Klantari,, The Calculation of vibrational energy levels of polyatomic molecules including anharmonic effect using contact transformation perturbation method

International Journal of Quantum Chemistry, 113, 1180-1191, 2013

16. M. Mansoori Kermani, M. Dehestani, Solving the nonlinear equations for one-dimensional nano-sized model including Rydberg and Varshni potentials and Casimir force using the decomposition method, , , , .

Applied Mathematical Modeling, 37, 3399-3406, 2013

17. M. Dehestani, S. Shojaei, A. Khosravan, Theoretical investigation of electronic excitation transfer between chlorophylls in light-harvesting antenna of photosystem II using quantum computer

Quim Nova, 35, 1800-1805, 2013

18. F. Shojaie, M. Dehestani, Theoretical calculations of rate of NDMA formation from gramine

Canadian Journal of Chemistry, 91, 4, 275-282, 2013

19. M. Dehestani, F. Shojaie, Multichannel RRKM study on the mechanisms and kinetics for the CH3Cl +OH reaction

International Journal of Quantum Chemistry, 112, 1307-1315, 2011

20. F. Shojaie, M. Dehestani, Vibrational mode analysis for the multi-channel reaction of CH3Cl + OH

International Journal of Quantum Chemistry, 2011

21. M. Dehestani, M. Mansoori Kermani,, Theoretical investigation of absorption spectrum of SO2 molecule: Including S1–S2.

Computational and Theoretical Chemistry, 978, 1-6, 2011

22. M. Dehestani, E. Akbari, Absorption and resonance Raman spectroscopy of the 1Bu state of 1,3,5 trans hexatriene including vibronic coupling

Journal of Raman Spectroscopy, 42, 1640-1652, 2011

23. M. Dehestani, F. Shojaie, The simulation of virus life cycle with quantum gates

Computers in Biology and Medicine, 40, 359, 2010

24. M. Dehestani, Calculation of absorption and resonance Raman cross sections of ClO2 in the gas-phase and in solution: including Duschinsky effects

Journal of Raman Spectroscopy, 40, 696-702., 2009

25. , The effects of Displacement, Distorted and Rotated Potentials Surfaces on Absorption and Resonance Raman Cross Sections of trans-Stilbene Molecule"

Int. J. Quant. Chem., 103, 119, 2005

26. , Ab initio Calculations and Rate Constant for the reaction H+ H2

Asian J. Chem., 17, 1863, 2005

27. M. Dehestani, F. Shojaie, initio Calculations and Rate Constant for the reaction H+ H2

Asian J. Chem., 17, 1863, 2005

28. M. Dehestani, Density Matrix Method Application to Resonance Raman Scattering

Asian J. Chem., 16, 1093-1103, 2004

29. R. Islampour, M. Dehestani, S. H. Lin, Calculation of Resonance Raman Excitation Profiles'

Mol. Phys., 98, 101--110, 2000

30. R. Islampour, M. Dehestani, S. H. Lin, A New Expression for Multidimensional Franck-Condon Integrals

J. Mol. Spectros, 194, 179-184, 1999

31. بتول السادات موسوی فرد، لیلا زیدآبادی نژاد، صدیقه پوراسترآبادی، مریم دهستانی, بررسی برهمکنش وانیلین با آلفا-، بتا- و گاما- سیکلودکسترین به‌عنوان حامل در سامانه‌های دارورسانی

مجله دانشکده پزشکی، دانشگاه علوم پزشکی تهران, 73, 872-877, 1394