۱۳۹۶/۰۶/۳۱
CV
First Name : MH
Last Name : Ghatee
Date of Birth : 1952
Marrital Status : Married
Last Academic Degree : Ph.D
Date of Employment : 1979
Academic Rank : Professor
Department : Chemistry
College : College of Sciences
Address :
Phone :
Cell Phone :
Email : ghatee@susc.ac.ir

Education Qualifications
PHD
Field: Physical Chemistry
Shiraz (Iran)
Years: 1993 to 1993
MSc
Field: Chemistry
Shiraz (Iran)
Years: 1976 to 1979

Honor And Awards
1-Distinguished Chemist of the Year (2014)
2-Ninth Kharazmi International Festival Award (1997)

Published Papers in Academic Journals
1- Ghatee M, Ghaedsharaf T (2017) "An Experimental Study on the Surface Properties of Protic Morpholinium-Based Ionic Liquids " Journal of Molecular Liquids 241:694-703
2- Ghatee M, Bahrami M (2017) "Emergence of innovative properties by replacement of nitrogen atom with phosphorus atom in quaternary ammonium ionic liquids: Insights from ab initio calculations and MD simulations " Chemical Physics 490:92-105
3- Sedghamiz T, Bahrami M, Ghatee M (2017) "Enantiospecific adsorption of propranolol enantiomers on naturally chiral copper surface MD Simul " Chemical Physics 487:48-58
4- Ghatee M, Shabih M (2017) " Aggregation behavior of asphaltene of different crude oils as viewed from solution surface tension measurementOriginal " Journal of Petroleum Science and Engineering, 151:275-283
5- Zolghadr A, Ghatee M, Moosavi F (2016) "The Effect of Various Quantum Mechanically Derived Partial Atomic Charges on the Bulk Properties of Chloride-Based Ionic Liquids " Chemical Physics 475:23-31
6- Ghatee M, Namvar S, Zolghadr A, Moosavi F (2015) "Why is the electroanalytical performance of carbon paste electrodes involving ionic liquid binder higher than paraffinic binders? a simulation investigation " Physical Chemistry Chemical Physics 17:24722-24731
7- Ghatee M, Karimi H, Shekoohi K (2015) "Structural, Mechanical and Thermodynamical Properties of Silver Amalgam Filler: A Monte Carlo Simulation Study " Journal of Molecular Liquids 211:96-104
8- Ghatee M, Fotoohabadi Z, Zolghadr A, Ghanavati F, Borousan F (2015) "Molecular dynamics studies of binary mixtures of pyridine and alkyl derivatives in n-octane " Fluid Phase Equilibria 393:101-110
9- Ghatee M, Koleini M, Ayatollahi S (2015) "Molecular Dynamics Simulation Investigation of Hexanoic Acid Adsorption onto Calcite (101¯4) Surface " Fluid Phase Equilibria 387:24-31
10- Ghatee M, Sedghamiz T (2014) "Chiral recognition of Propranolol enantiomers by ?-Cyclodextrin: quantum chemical calculation and molecular dynamics simulation studies " Chemical Physics 445:5-13
11- Zolghadr A, Ghatee M, Zolghadr A (2014) "Adsorption and Orientation of Ionic Liquids and Ionic Surfactants at Heptane/Water Interface " The Journal of Physical Chemistry C 118:19889-19903
12- Ghatee M, Ghazipoor H (2014) "Highly accurate liquid–liquid interfacial tension measurement by a convenient capillary apparatus " Fluid Phase Equilibria 377:76-81
13- Ghatee M, Zolghadr A (2013) "Local Depolarization in Hydrophobic and Hydrophilic Ionic Liquids-Water Mixtures: Car–Parrinello and Classical Molecular Dynamics Simulation " J. Phys. Chem. C 117:2066-2077
14- Ghatee M, شكوهي (2013) "Structures, thermal stability, and melting behaviors of bimetallic Cs-Na clusters studied via molecular dynamics simulation " Fluid Phase Equilibria 355:114-122
15- Ghatee M, Taslimian S (2013) "Investigation of temperature and pressure dependent equilibrium and transport properties of liquid acetone by molecular dynamics simulation " Fluid Phase Equilibria 358:226-232
16- Ghatee M, Fotohabadi Z, Zolghadr A, Borousan F, Ghanavati F (2013) "Structural and phase behavior studies of pyridine and alkyl pyridine at the interface of oil/water by molecular dynamics simulation " Industrial and Engineering Chemistry Research 52:13384-13392
17- Ghatee M, Bahrami M, Khanjari N (2013) "Measurement and study of density, surface tension, and viscosity of quaternary ammonium-based ionic liquids ([N222(n )]Tf2N) " Journal of Chemical Thermodynamics 65:42-52
18- Ghatee M, Pakdel L (2013) "Pyridine adsorption on small Nin-cluster (n = 2,3,4): A study of geometry and electronic structure " International Journal of Quantum Chemistry 113:1549-1555
19- Ghatee M, Karimi H (2013) "Monte Carlo simulation of the static properties of Hg solution in (O 2, N2) gassed water " Journal of Molecular Liquids 181:14-19
20- Ghatee M, Ghanavati F, Bahrami M, Zolghadr A, Borousan F, Fotohabadi Z (2013) "Molecular dynamics simulation and experimental approach to the temperature dependent surface and bulk properties of hexanoic acid " Industrial and Engineering Chemistry Research 52:3334-3341
21- Ghatee M, Pakdel L (2013) "Development of structure/property relation based on surface thermodynamic properties of alkyl-pyridine and aliphatic amines " Journal of Molecular Liquids 177:376-385
22- Asadi M, Ghatee M, Torabi S, Mohammadi K, Moosavi F (2013) "Vanadyl Binary Schiff Base Complexes Containing N2O2 Coordination Sphere: " J of the Korean Chemical Society 57:63-72
23- Asadi M, سواري پور , Asadi Z, Ghatee M, Moosavi Baygi F, Yousefi R, Jamshidi M (2013) "Synthesis and characterization of some new Schiff base complexes of group 13 elements, ab initio studies, cytotoxicity and reaction with hydrogen peroxide " Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy 101:394-399
24- Ghatee M, Zare M, Pakdel L (2012) "An insight into the dynamic crossover phenomenon in alcohols from the fluidity equation " Fluid Phase Equilibria 336:98-103
25- Ghatee M, Hemmateenejad B, Sedghamiz T, Khosousi T, Ayatollahi S, Seiedi O, Sayyad amin J (2012) "Multivariate Curve Resolution Alternating Least-Squares As a Too for Analyzing Crude Oil Extracted Asphaltene Samplesl " Energy & Fuels 26:5663-5671
26- Ghatee M, Zolghadr A, Moosavi F, انصاري (2012) "Studies of structural, dynamical and interfacial properties of 1-alkyl-3-methylimidazolium iodide ionic liquids by molecular dynamics simulation " J. Chem. Phys. 136:124706-14
27- Ghatee M, Moosavi F, Zolghadr A (2012) "Molecular dynamics simulation studies of new aspects of structural and dynamical properties of n-butyl formate at varying temperature " JOURNAL OF MOLECULAR LIQUIDS 167 :5-13
28- Rahbar M, Roosta A, Ayatollahi S, Ghatee M (2012) "Prediction of Three-Dimensional (3-D) Adhesion Maps, Using the Stability of the Thin Wetting Film during the Wettability Alteration Process " Energy and Fules 26:2182-2190
29- Bahadori M, Rasouli S, Ghatee M (2012) "Optimally parameterized interionic potential function for liquid alkali metals " journal of Molecular liquids 165:44-48
30- Ghatee M, Hemmateenejad B, Sedghamiz T, Khosousi T, Ayatollahi S, Seiedi O, Sayyad amin J (2012) "Multivariate Curve Resolution Alternating Least-Squares As a Tool " Energy and Fules 26:5663-5671
31- Ghatee M, Moosavi F, Zolghadr A (2012) "Molecular dynamics simulation studies of some new aspects of structural and dynamical properties of n-butyl formate at varying temperature " Journal of Molecular Liquids 167:5-13
32- Ghatee M, Zolghadr A, Moosavi F, انصاري (2012) "Studies of structural, dynamical, and interfacial properties of 1-alkyl-3-methylimidazolium iodide ionic liquids by molecular dynamics simulation " Journal of Chemical Physics 136:124706-1234720
33- Ghatee M, Bahrami M, Khanjari N, Firozabadi H, Ahmadi Y (2012) "A functionalized high-surface-energy ammonium-based ionic liquid: Experimental measurement of viscosity, density, and surface tension of (2-hydroxyethyl)ammonium formate " Journal of Chemical and Engineering Data 57:2095-2101
34- Ghatee M, Shekoohi K (2012) "Melting profile of cesium metal nanoclusters by molecular dynamics simulation " Fluid Phase Equilibria 327:14-21
35- Ghatee M, Zolghadr A, Moosavi F, Pakdel L (2011) "The Extent of Molecular Orientation at Liquid-Vapor Interface of Pyridine and its Alkyl Derivatives by Molecular Dynamics Simulation " J. Chem. Phys. 134:074707-14
36- Ghatee M, Zare M (2011) "Power-law behavior in the viscosity of ionic liquids: Existing a similarity in the power law and a new proposed viscosity equation " Fluid Phase Equilibria 311:76-82
37- Ghatee M, Moosavi F (2011) "Physisorption of Hydrophobic and Hydrophilic 1-Alkyl-3-methylimidazolium Ionic Liquids on the Graphenes " Journal of Physical Chemistry C 115:5626-5636
38- صيادامين , نيكويي , Ghatee M, Ayatollahi S, Alamdari A, Sedghamiz T (2011) "Investigating the Effect of Different Asphaltene Structures on Surface Topography and Wettability Alteration " Applied Surface Science 257:8341-8349
39- Ghatee M, Zolghadr A (2011) "The extent of molecular orientation at liqui/vapor interface of pyridine " Journal of Chemical Physics 134:0747071-07470714
40- Ghatee M, Moosavi F, Zolghadr A, Jahromi R (2010) "Critical Point Temperature of Ionic Liquids from Surface Tension at Liquid Vapor Equilibrium and the Correlation with Interaction Energy " Industrial and Engineering Chemistry Research 49 :12696-12701
41- Ghatee M, Zare M, Moosavi F, Zolghadr A (2010) "Temperature-Dependent Density and Viscosity of ILs 1-Alkyl-3-Methylimidazolium Iodide Experiment and MD Dynamics Simulation " Journal of chemical and Engineering Data 55 :3084-3088
42- Ghatee M, Zare M, Zolghadr A, Moosavi F (2010) "Temperature Dependence of Viscosity and Relation with Surface Tension of Ionic Liquids " Fluid Phase Equilibria 291 :188-194
43- Ghatee M, Moosavi F, Zolghadr A, Jahromi R (2010) "Critical-Point Temperature of Ionic Liquids from Surface Tension at Liquid?Vapor Equilibrium and the Correlation with the Interaction Energy " Industerial and Engineering Chemistry Research 49:12696-12701
44- Asadi M, Ghatee M, Torabi S, Mohammadi K, Moosavi F (2010) "Synthesis, ab initio Calculations, Thermal, Thermodynamic and Antioxidant.... " J of the Iranian Chem. soc. 7:1021-1035
45- Asadi M, Ghatee M, Torabi S, Mohammadi K, Moosavi F (2010) "synthesis characterization abinitio calculation thermal behaviour and thermodynamics of some oxovanadium complexes invo " J of Chemical Science 122:539-548
46- Ghatee M, Zare M, Moosavi F, Zolghadr A (2010) "Temperature-Dependent Density and Viscosity of ILs 1-Alkyl-3-Methylimidazolium Iodide Experiment and MD Dynamics Simulation " Journal of Chemical and Engineering Data 55:3084-3088
47- Ghatee M, Zare M, Moosavi F, Zolghadr A (2010) "Temperature dependence of viscosity and relation with the surface tension of ionic liquids " Fluid Phase Equilibria 291:188-194
48- Ghatee M, Zolghadr A (2008) "Surface tension measurements of imidazolium based ionic liquids at liquid/vapor equilibrium " Fluid Phase Equilibria 263 :168-175
49- Ghatee M, نيرومندحسيني (2007) "Hard-wall potential function for transport properties of alkali metal vapors " J. Chem. Phys. 126:014302-0
50- Ghatee M, بهادري دشت ارژندي (2007) "Inter-ionic potential function in liquid alkali metals by thermodynamic regularity approach " Chemical Physics 335:215-220
51- Ghatee M, انصاري (2007) "Ab initio molecular dynamics simulation of ionic liquids " J. Chem. Phys 126:154502-0
52- Ghatee M, باقري (2006) "Subcritical and supercritical thermodynamic properties of compressed Xe and Cl2 fluids " Fluid Phase Equilibria 246:28-33
53- Ghatee M, نيرومندحسيني (2006) "Equation of state and manifestation of non-spherical contribution of interaction potential in liquid rubidium metal " Fluid Phase Equilibria 244:172-178
54- Ghatee M, سنچولي (2006) "Structural properties of liquid cesium metal by application of cohesive energy density " Fluid Phase Equilibria 240:22-28
55- Ghatee M, سورغالي (2006) "Application of Extended Scaling Lawto the Surface Tension of Fluids of Wide Range of Molecular Shape " Fluid Phase Equilibria 249:153-158
56- Ghatee M, پاكدل (2005) "Surface tension regularity of non-polar, polar, and weak electrolyte liquid hydrocarbons " Fluid Phase Equilibria 243:101-107
57- Ghatee M, Shekoohi K (2005) "Relation between surface tension and isothermal compressibility: application of statistical mechanical equation of state " Fluid Phase Equilibria 227:1-7
58- Ghatee M, بهادري دشت ارژندي (2005) "Characterizing phase transitions in liquid cesium by a soft-core and large-attraction equation of state " Fluid Phase Equilibria 233:151-156
59- Ghatee M, نيرومندحسيني (2004) "Contribution of Dispersive Second Virial Coefficient of Liquid Cesium Metal " J. Phys. Chem. B 108:10034-10040
60- Ghatee M, بهادري دشت ارژني (2004) "Density-Dependent Equations of State for Metal, Nonmetal, and Transition States for Compressed Mercury Fluid " J. Phys. Chem. B 108:4141-4146
61- Ghatee M, مالكي , قايدشرف (2003) "Extended Generic Nature of Surface Entropy " Langmuir 19:211-213
62- Ghatee M, سنچولي (2003) "Viscosity and thermal conductivity of cesium vapor at high temperatures " Fluid Phase Equilibria 214:197-209
63- Ghatee M, بهادري دشت ارژندي (2003) "Common compression factor and bulk modulus quiescence points of liquid cesium " Fluid Phase Equilibria 20:339-351
64- Ghatee M, شمس ابادي (2001) "Linear Exp-6 Isotherm for Compressed Molten Cesium over the Whole Liquid Range Including Metal?Nonmetal Transition and Tc " J. Chem. Phys. B 105:702-710
65- Ghatee M, سنچولي (2001) "Second virial coefficients of alkali metals from diatom fractions and assessment of ISM EOS by real data " Fluid Phase Equilibria 189:63-83
66- Ghatee M, بهادري دشت ارژني (2001) "New Thermodynamic Regularity for Cesium over the Whole Liquid Range " J. Phys. Chem. B 105:11256-11263
67- Ghatee M (2000) "Linear correlation of heat of vaporization with surface tension of normal and quantum liquids: intrinsic conservation of degrees of freedom " Fluid Phase Equilibria 170:1-11
68- Ghatee M, فارسي (2000) "Determination of ISM equation of state for liquids from surface energy: a simplified procedure for mixtures " Fluid Phase Equilibria 175:237-251
69- Ghatee M, پاپري , Booshehri A (1999) "Semi-Empirical Calculations of the Transport Properties of Eight Binary Gas Mixtures at Low Density by the Inversion Method: Part II " Bulletin of the Chemical Society of Japan 72:931-936
70- Ghatee M (1999) "Quantum mechanical law of corresponding states from ISM equation of state: compressed liquids " Fluid Phase Equilibria 161:77-89
71- Ghatee M, موسي زاده , Booshehri A (1998) "Linear Isotherm for Compressed Molten Alkali Metals " International Journal of Thermophysics 19:317-330
72- Ghatee M, پاپري , Booshehri A (1997) "Direct Calculation of CH4–He Interaction Potential from the Extended Principle of Corresponding States " Bulletin of the Chemical Society of Japan 70:2643-2646
73- Ghatee M, موسي زاده , Booshehri A (1997) "Corresponding states correlation for the surface tension of molten alkali halides " High Temperatures - High Pressures 29:717-722
74- Ghatee M, Booshehri A (1996) "A New Property of the ISM Equation of State " Journal of Physical Chemistry 100:1896-1899
75- Ghatee M, Booshehri A (1996) "Equation of state for compressed liquids from surface tension " International Journal of Thermophysics 16:1429-1438
76- Ghatee M, Booshehri A (1994) " Corresponding-states correlations for the surface tension of molten alkali metals " High Temperatures. High Pressures 26:507-514
77- Ghatee M, Booshehri A (1994) "Modulation of the integrated rate equation of a composite system for the kinetic parameters " Chemometrics and Intelligent Laboratory Systems 25:43-49
78- Ghatee M, Booshehri A (1994) "An Analytical Equation of State for Molten Alkali Metals " International Journal of Thermophysics 16:1429-1438
79- Ghatee M (1993) "A simple device for conductivity experiments " Journal of Chemical Education 70:44-45

Papers and Abstracts in Conference Proceedings
1-Ghatee M, Pezeshki M "Study of Bulk Properties of Morpholinium-based Ionic Liquids by Molecular Dynamics Simulation " نوزدهکين کنگره شيمي ايران (2017)
2-Ghatee M, Ghaedsharaf T "An Experimental Study on the Surface Properties of N-Methylmorpholinium-Based Ionic Liquids " نوزدهمين کنگره شيمي ايران (2017)
3-Ghatee M, Behrouz M "EDFT Study and Molecular Docking Simulation of Some Lung Cancer Drugs with Epidermal Growth Factor Receptor Tyrosine Kinase " بيستمين کنفرانس شيمي فيزيک ايران - دانشگاه اراک (2017)
4-Ghatee M, Behrouz M "DFT Study of a Novel Cucurbit[n]uril-type Molecular Container " بيستمين کنفرانس شيمي فيزيک ايران (2017)
5-Ghatee M, Bahrami M "Wetting and Interfcial Behavior of Hydrophobic Ionic Liquids Nanodroplets on Copper Metal Surface " 24th Iranian Seminar of Organic Chemistry (2016)
6-Sedghamiz T, Bahrami M, Ghatee M "Enantiospecific Adsorption of Propranolol Eanatiomeres on Naturally Chiral Copper Surface " 24th Iranian Seminar of Organic Chemistry (2016)
7-Zolghadr A, Ghatee M "Molecular Dynamics Simulation of Interfacial tension Reduction at Oil/Water Interface by using ILs as Surfactant " شيمي فيزيک ايران (2014)
8-Ghatee M, Sedghamiz T "QUANTUM MECHANICAL AND MOLECULAR DYNAMICS APPROACH TO THE CHIRAL RECOGNITION BY INCLUSION COMPLEXATION " Drug Discovery and Therapy World Congress 2014 (2014)
9-Ghatee M, Zolghadr A "Local Depolarization in Hydrophobic and Hydrophilic Ionic Liquids/Water Mixtures: Car-Parrinello and Classical Molecular Dynamics Simulation " 15th Iranian Physical Chemistry Conference (2012)
10-Ghatee M, Zolghadr A, Moosavi F "Hydrophobicity and Hydrophilicity in Ionic Liquids: Car-parrinello and Classical Molecular Dynamics Simulation " CPMD2011-Extending the limits of ab initio MD (2011)
11-Ghatee M, Zolghadr A "Molecular Dynamics Simulation of Bulk and Surface Properties of 1-Alkyl-3-Methyl Imidazolium Iodide Ionic Liquids " 14th Iranian Physical Chemistry Conference (2011)
12-Ghatee M, Zolghadr A "Hydrophobic and Hydrophilic Ionic Liquids: Car-Parrinello and Classical Molecular Dynamics Simulation " CPMD2011 Extending the limits of Ab initio Molecular Dynamics Simulations for Chemistry Materials Science and Biophysics (2011)
13-Ghatee M, Zolghadr A "Investigation of Molecular Orientation at Liquid-Vapor Interface by Molecular Dynamics Simulation " 13th Iranian physical chemistry seminar (2010)
14-Ayatollahi S, Ghatee M "The Roles of Nano-Scale Intermolecular Forces on the Film Stability During " Trinidad and Tobago Energy Resources Conference (2010)
15-Ghatee M, Namvar S, Zolghadr A "Molecular dynamics Simulation of Graphite Mixed with Electroanalytical Binders: Recognized Ioni Liquids Over " 8th Liblice Conference on the Statistical Mechanics of Liquids (2010)
16-Ayatollahi S, Ghatee M "Monitoring the Wettability of Oil Reservoir Rocks by AFM during Surfactant Treatment " International Petroleum Conference & Exhibition (2009)
17-Ayatollahi S, Ghatee M "Macroscopic, Microscopic Investigation of Wettability Alteration of Iranian Oil Field Rock Using Surfactants " Abu-Dhabi UAE 2008 Wettability conference (2008)
18-Ghatee M, Bahrami M "ْStructural and dynamical properties of quternary ammonium based ionic liquids: a molecular dynamics simulation study " هفدهمين سمينار شيمي فيزيک اران (1393)
19-Ghatee M "Properties of Liquids, Solutions and their Interfaces " اولين گنگره شهداي شيمي و هفدهمين گنگره شيمي (1393)
20-Ghatee M, Fotohabadi Z "Study of the properties of pure oil and oil/water interface by molecular dynamics simulation " 15th PChem Seminar (1393)
21-Javidialesaadi A, Ghatee M, Raeissi S "Molecular dynamics simulation of density of supercritical carbon dioxide " چهاردهمين کنگره ملي مهندسي شيمي ايران (1391)
22-Ghatee M, Shekoohi K "Molecular Dynamics Simulation of the Melting Behavior of Cs-Na Bimetallic Nanoparticles " 15th PChem Seminar (1391)
23-Ghatee M, Bamdad F "An experimental study on surface properties of amino acid solutions " 15th PChem Seminar (1391)
24-Ghatee M, Ghanavati F "Study of surface tension, density and viscosity of hexanoic acid by MD simulation and experimental measurements " 15th PChem Seminar (1391)
25-Ghatee M, Borousan F "Study of structural behavior of hexylamine at the interface of water/oil by molecular dynamics simulation " 15th PChem Seminar (1391)
26-Ghatee M, Zare M "Study of surface tension, density and viscosity of hexanoic acid by MD simulation and experimental measurement " !5th PChem Seminar (1391)
27-Ghatee M, Bahrami M, Khanjari N, Ayatollahi S, Seiedi O "Temperature dependent behavior of CTAB and Triton X-100 surfactants in relation to the Oil recovery enhancement efficiency " چهاردهمين سمينار شيمي فيزيک (1389)
28-Ghatee M, Zare M "Theoretical Study of the Effect of C/Si Exchange on the Properties of n- " چهاردهمين سمينار شيمي فيزيک (1389)
29-Ghatee M, Taslimian S "Equilibrium and Transport Properties of Acetone and Poly (methyl " چهاردهمين سمينار شيمي فيزيک (1389)
30-Ghatee M, صدق آميز "Studies of Asphaltene Aggregation and Solvation Mechanisms by MD Simulation " چهاردهمين سمينار شيمي فيزيک (1389)
31-Ghatee M, Pakdel L "Molecular orientation at liquid/vapor interface by the study of surface thermodynamic functions " چهاردهمين سمينار شيمي فيزيک (1389)
32-Ghatee M, Moosavi F, Zolghadr A, Jahromi R "The Correlation of Interaction Energy with Critical Point Temperature ofIonic Liquids obtained from Surface Tension " چهاردهمين سمينار شيمي فيزيک (1389)
33-Ghatee M, Zolghadr A, Moosavi F "MD Simulation of Bulk/Surface Structure of ILs 1-Alkyl-3-Methylimidazolium Iodides " چهار دهمين سمينار شيمي فيزيک (1389)
34-Ghatee M, Shekoohi K "Characterizing phase transition in liquid cesium with voronoi-tessellation method " سيزدهمين سمينار شيمي فيزيک ايران (1389)
35-Ghatee M, Zare M "Temperature dependence of viscosity and relation with the surface tension of ionic liquids " سيزدهمين سمينار شيمي فيزيک ايران (1389)
36-Ghatee M, Zolghadr A "Investigation of molecular orientation at liquid-vapor interface by molecular dynamic simulation " سيزدهمن سمينار شيمي فيزيک ايران (1389)
37-Ghatee M, Moosavi F "Bulk and surface properties of formate esters by the application of SAFT-VR and molecular dynamics simulation " سيزدهمين سمينار شيمي فيزيک ايران (1389)
38-Ghatee M, Moosavi F, Jahromi R "Active C-H bond and rational of the anion-cation structural pattern in the ionic liquids 1-alkyl-3- " سيزدهمين سمينار شيمي فيزيک ايران (1389)

Books


Courses Taught
Bachelor's
General Chemistry 1
General Chemistry2
General Chemistry Lab 1
General Chemistry Lab2
Glass Blowing lab
Quantum Chemistry Fundamentals
Reaserch and Report Writing Practice
Seminar on Chemistry
Chemical Engineering General Chemistry
General Chemistry
Basic General Chemistry
Master's
MSc Thesis
MSc Thesis
MSc Thesis
MSc Thesis
MSc Thesis
MSc Thesis
MSc Thesis
MSc Thesis
Seminar 1
Seminar 2
Special Topic in Organic Chemistry
Special Topics in Analytical Chemistry
Advanced Physical Chemistry
Surface Chemistry
Recent Topics in Physical Chemistry
Special Topics in Physical Chemistry
Statistical Thermodynamics
Special Subjects in Inorganic Chemistry
Special Topics in Inorganic Chemistry
PhD
PhD Thesis
PhD Thesis
PhD Thesis
PhD Thesis
PhD Thesis
PhD Thesis
PhD Thesis
PhD Thesis
PhD Thesis
PhD Thesis
PhD Thesis
PhD Seminar 1
PhD Seminar 2
Introduction to PhD Research
Special Topics in Chemistry (PhD)
Preparing for Comprehensive Exam
Chemistry Comprehensive Exam
New Topics in Analytical Chemistry
Statistical Mechanics1
Statistical Thermodynamics 2 (PhD)
Special Subjects in Physical Chemistry
Recent Topics in Physical Chemistry
Computer in Chemistry
Recent Topics in Inorganic Chemistry- PhD
Special Topics in Organic Chemistry, PhD
Master's
Surface Chemistry
PhD
Master's
Chemistry of Surfaces

Graduate Thesis Advisor (53)
PhD
Student FullName Subject Defense Year
MSc
Student FullName Subject Defense Year
Graduate Thesis Advisor (59)
Maryam Bahrami Study of Bulk and Surface properties of Quaternary Ammonium-based Ionic Liquids by Molecular Dynamics Simulation
Mohammad Mehdi Koleini Adsorption of surfactants on mineral calcite surface: modeling and simulation investigation
Tahereh Sedghamiz Molecular Dynamics Simulation of Inclusion Complexes Involving Cyclodextrin and Cucurbituril Type Molecules: Chiral Recognition of Propranolol and Naproxen
Saiedeh Taslimian
Hedayat Karimi A Molecular Simulation Approach to the Properties and Structure of Hg/(H۲O, O۲, N۲) Mixture, Hg/(Ag, Cu) Amalgam and Liquid Sodium Metal Systems
Khadijhe Shekoohi The Study of Metals and their Nanoclusters Properties by Molecular Dynamic Simulation
Leila Pakdel
Morteza Zare
Amin Reza Zolghadr
Fatemeh Moosavi Ionic liquids: physical properties, liquid/vapor interfacial behavior, electronic structure, and adsorption on solid surface
Thermodynamic, transport and phase transition in normal and metallic fluids
Thermodynamics of Mercury and Liquid Alkali Metals by Potential and Pseudopotential Approaches
Maryam Samanian Investigation of Properties of Monolayer and Bilayer MoS۲ and MoS۲/Ionic Liquid Interface: Simulation and Molecular Modeling
SeyyedehFatemeh Ayatollahi Investigating the electrochemical features of lithium-electrode and ionic liquid electrolyte by molecular dynamics simulation
Maliheh Pezeshki Study of Bulk Thermophysical and Surface Properties of Morpholinium-based Ionic Liquids by Molecular Dynamics Simulation
Zeinab Fotoohabadi Simulation investigation of hydrophobic and hydrophilic ionic liquids behaviors at electrochemical graphite-liquid interface
Tahereh Ghaedsharaf Molecular Dynamics Simulation of Ionic Liquids as a Biological Membrane
Marzieh Behrouz Molecular Dynamics Simulation and Quantum Chemical Studies of a Novel Cucurbit[n]uril–Type Molecular Container in Drug Delivery
PhD
Student FullName Subject Defense Year
Fatemeh Keshavarz Part A: Methanol Production through CO۲ Hydrogenation over Cu-Based Layered Double Hydroxides Catalyst, Part B: Dynamics of the CH Reaction with O۲, Part C: Dynamics and Kinetics of the NH۲ Reaction with HO۲
Marziyeh sadat Masoumpour Part A: A Theoretical Study on the Kinetics of the Reaction of HO۲+H۲S ,Part B: A Theoretical Study on the Dynamics and Kinetics of the Reactionof H۲S+O
Vahid Zarei Part A: Hydrogen Formation from Hydrocarbons by High Frequency, High Voltage and Low Current Spark Discharge Plasma: Methane, Ethylene and Natural Gas Conversion Part B: A Theoretical Study on the Kinetics of Amidogen Radical (NH۲) with Ozone (O۳) Reaction
Saba Shariati Quantum Chemical Study on Sub-Nanoparticles: Small Chromium and Copper Clusters as Model Catalysts for Activating Chemical Bonds
Akbar Omidvar Theoretical Study on the Design and Applications of Nanomaterials for Solar cell, Gas Sensor, Optoelectronic and Hydrogen Storage Devices
Seyede somayeh Asemani A theoritical study on the kinetics dynamics of HNO with HO۲ reaction and reaction dynamics of HN(T)+OH(D) on an interpolated potential energy surface
Elham Dehghanpisheh Quantum Mechanical Investigation of Structures and Properties of Co, Co/Cr Small Clusters and Their Interactions with O۲ and C۲H۴
Farideh Pahlavan Theoretical study of electronic structure of small transition metal clusters and their interaction with some small organic molecules
Seyede Maryam Mortazavi A Theoretical Investigation on the Potential Enegy Surface, Kinetics and Mechanism of H۲S ‏+ O۳ Reaction& A Theoretical Study on the Dynamics of the C۲H۴+ S Reaction on an Interpolated Potential Energy Surface
Mojtaba Alipour ۱- Density functional theory: Prospects and Applications ۲- On the optical, electronic and structural properties of some nanoclusters
Zahra Homayoon Kinetics and Dynamics of Methanol Oxidation
Ali Mashreghi
Samira Siahrostami Theoretical investigation of chemical properties of some compounds
Fatemeh Pirhadi Multichannel RRKM-TST and Direct-Dynamics VTST Study & Dynamic Study on an Interpolated Potential Energy Surface of the Reaction of Amidogen with Hydroxyle Radical
Susan Torabi Synthesis, Characterization, Ab initio Calculations, Thermal, Thermodynamic and Antioxidant Properties of Some Oxovanadium(IV) Complexes Containing O,O- , N,N- and N,O- Donor Sphere and Synthesis, Characterization and Thermodynamics of Some New Unsymmetrical Co(III) Schiff Base Complexes Derived from ۲,۳- and ۳,۴-diaminopyridine
Maryam Farrokhnia Theoretical study of molecular properties in some categories of biological molecules
Narges Bagheri STUDY ON MECHANICAL QUANTUM CHEMICAL PROPERTIES OF i- AROMATICITY BASED ON ELECTROSTATIC FIELD GRADIENTii- THE NATURE OF SIGMA-HOLE BOND COMPLEXES iii- DIPEPTIDES CONFORMERS
Multichannel RRKM-TST and Direct-Dynamics VTST Study of the Reaction of Furan with Hydroxyl and Methyl Radicals
Theoretical Study on the Kinetics of Unimolecular Reaction of ۱,۲-Dichloroethane and Bimolecular Reaction H + HOO , Synthesis and characterization of Silicon Carbide Nanosturctures
Electronic structure analysis of some chemical bonds and their properties
Theoretical Studies of Some Molecular Properties
Theoretical Evaluation of Equilibrium Thermodynamic and Transport Properties of Alkali Metals Using Characteristics Interatomic Potential Functions
Statistical Investigation of Low Energy Level Schemes
Elham Mazarei Part A: A Theoretical Study on the Kinetics of the Reaction of CH۳OH with HO۲, Part B: A Classical Trajectory Study of Reaction of CH with H۲O on an Interpolated Potential Energy Surface
Nasim Hasani Part A: A Theoretical Study on the Reaction of O۲ with NO on the Surface of Iridium Nano–Clusters , Part B: A Theoretical Study on the Dynamics and Kinetics of Some Reactions Involve in Hydrogen Flame
Samaneh Moosavi A Theoretical Study on the Kinetics and Dynamics of the CH۲ and OH Reaction
Soheila Zirrahi Study of surface structural and thermodynamic properties of NaCl aqueous solution by molecular dynamics simulation
Narjes Ghafarijoo Experimental Surface Tension Measurement and Investigation of Thermodynamic Properties at Interface of Air/Electrolyte and Hydrocarbon/Electrolyte Solutions
Samira Bahadori Haghighi Experimental Surface Tension Measurement and Investigation of Thermodynamic Properties at Interface of Air/Electrolyte and Polar-Hydrocarbon/Electrolyte Solutions
Haideh Balali Dehkordi Measurement of interfacial tension of long-chain-alcohols/electrolyte-solutions system as a function of temperature and concentration
Leila Sakhtemanian Experimental Surface Tension Measurement and Investigation of Thermodynamic Properties at Interface of Air/Electrolyte and Nonpolar-Oil/Electrolyte Solutions
Manije Shabih Surface Tension Measurement of Asphaltenes Solutions: Characterization and Features
Maryam Hashemi Investigation of Properties of Protic Ionic Liquids by Quantum Mechanical Calculation and ab initio molecular dynamics simulation
Parisa Mamoozadeh Viscosity measurement of morpholinium-based ionic liquids
Tahereh Ghaedsharaf An Experimental Study on Surface Properties of Morpholinium-based Ionic Liquids
Ramin Eradeh Preparation of Graphene by Liquid Phase Exfoliation Involving Ionic Liquids and the Study of the Role of Surface Thermodynamics Properties
Mansoore Tahayori study of the bulk and interfacial structure of amino acids aqueous solutions by molecular dynamics simulation
Haleh Ghazipoor An experimental study on the surface properties of aqueous solutions of cyclic amino acids
Abdolreza Javidialesaadi CO۲ Capture with Ionic Liquids: A Molecular Dynamics Simulation Study
Fatemeh Bamdad An Experimental Study On The Surface Properties Of aliphatic Amino Acid Solutions
Zeinab Fotohabadi Study of the structural behavior of pyridine and its alky derivatives at the interface of water/oil by molecular dynamics simulation
Fatemeh Borousan Study of structural behavior of aniline and hexylamin at the interface of water/oil by molecular dynamics simulation
Fatemeh Ghanavati Molecular Dynamics Simulation and Experimental Approach to the Temperature Dependent Surface and Bulk Properties of Acid/Water and Alcohol/Water Systems
Neda Khanjari Viscosity Measurement of Ammonium Based Ionic Liquids
Maryam Bahrami Surface Tension Measurements of Ammonium-Based Ionic Liquids
Mohammad mehdi Koleini ۱. Adsorption of Polar and Non-polar Liquid Hydrocarbons at the Crude . Experimental Measurement of Crude Oil
Marziyeh Rahbar ROLES OF INTERMOLECULAR FORCES ON FILM STABILITY DURING WETTABILITY ALTERATION PHENOMENON
Sedigheh Namvar Molecular Dynamic Simulation of Mixed Ionic Liquid and Graphite
Omolbanin Seiedi WETTABILITY ALTERATION OF RESERVOIR ROCKS DURING SURFACTANT FLOODING
Razieh Jahromi Investigation of properties of room temperature ionic liquids by molecular static and dynamic simulations
Tahereh Sedghamiz Computer simulation of solubility of asphaltene aggregates and
Lida Baghernezhad Role of Surfactants in Herbicides Delivery: Computer Simulation of Water-Polyoxy Ethylene Tallow Amine Solution of Glyphosate
Experimental Study of the Viscosity of Room Temperature Ionic Liquids Incorporating the imidazolium Cation
Ab initio molecular dynamic simulation of ionic liquids and liquid metals.
: Experimental study of surface properties of imidazolium based ionic liquids
DETERMINATION OF ISOTHERMAL COMPRESSIBILITY AND EVALUATION OF THE RELATION WITH SURFACE TENSION FOR NON-POLAR FLUIDS
SURFACE TENSION REGULARITY OF NON-POLAR, POLAR, AND WEAK ELECTROLYTES LIQUID HYDROCARBONDS
EXTENDED GENERIC NATURE OF SURFACE ENTROPY: APPLICATION TO LIQUIDS OF WIDE RANGE OF MOLECULAR SHAPES
Part ۱: Contribution of Dispersive Second Virial Coefficient of Liquid Cesium Metal Part ۲: Influence of Geometry on Light Harvesting in Dendrimeric Systems
Relation between Surface Tension and Isothermal Compressibility: Application of Statistical Mechanical Equation of State
Seyedeh parisa Towzihian Experimental Surface Tension Measurement and Investigation of Thermodynamic Properties at Interface of Air/Alcohol Solutions and Alcohol/Aqueous Solutions of Ionic Liquid
MSc
Student FullName Subject Defense Year
How Do Carbon Nanoparticles Interact with Membrane? Simulation and Experiment
Sedighe saadat Mosavi The Effect of Gold Nanoparticles on the Lipid Membrance: Experimental and Simulation Studies
Samaneh Boroomand Evaluation of HSP۹۰ Inhibitors Activity by Molecular Dynamics Simulation
Maryam Heydari dokoohaki Alzheimer’s Disease: A Molecular Dynamics Simulation Perspective
Nasimeh Laridashti Theoretical study of H۲O۲ adsorption on Fe- and N- doped (TiO۲)۵,(TiO۲)۶ nanoclusters
Hamid Etehad khub A Theoretical study on the mechanism and kinetics of the reaction of sulfur (۳P) atom with methane and ethane
Zahra Hasanshahi Experimental investigation of crude oil desalting using coated nanoparticles
Maryam Samanian Synthesis of new heterogeneous nanocatalyst based on carbon nanocomposite through formation of C-C bonds And Investigation of the kinetic effect of synthesized heterogeneous nanocatalyst on gas phase unimolecular reaction of methane
Shekofe Zangene eanalo A theoretical study of the Vibrational Energy Redistribution in the Chemically Activated CH۳OOH Complex
Theoretical Study On Binding of Copper II to Alzheimer`s Amyloid Beta
Tahere Bozorgizade theoretical study on the molecular interaction between small ammonia nanotubes and coinage metals
Mojgan Sadeghi A Theoretical Study on The Mechanism and Kinetics of Reaction of Methylthiyl Radical (CH۳S.) with Ozone (O۳)
Samad Amini Synthesis of nano – porous catalysts for Heterogeneous reactions in the gas phase
Maryam Safapour Theoretical study of reduction potentials of organic substituted flavins
Maryam Shahamat Effects of heterogeneous catalysts on gas phase reaction of some light organic compounds
Identification of Intermolecular Forces of Wax in Nano Scale for Precipitation Predict
Elnaz Zare Derisi Determination of experimental conditions of asphaltene precipitation using electrical potential
Soroor Sharifzadeh experimental study of polymeric surfatant by sol-gel method to improve relative permeability in gas condensate reserviors
Nasrin Hejazi Molecular Dynamics Simulation of Caesium
Sayed mohamad ali Zarrin hamedani Nano Graphene formation in spark assisted dissociation of Shiraz pipe line gas
Maryam Dehdashty jahromi a theoretical stuيy on the kinetic effects of zn (ch۳) as a raيical initiator in the aييition of the to imines
Elham Mazarie Quasi-Classical Trajectory Study on the Reaction of CH۳+SiCl۳ Radicals
Abolfazl Ashrafi Theoretical Study on Structure and Electronic Properties of Amino Acid Ionic Liquids
SARA SOLEIMANZADEGAN Quasi- Classical Dynamic Simulation of NH۲+HO۲ Reaction in Gas Phase
Omid Hemmatti EFFECT OF HYDROGEN SULFIDE ON THE DEPLETION OF OZONE, KINETICS AND MECHANISM
Abdolrasol Zare Theoretical Investigation of Molecular Wires
CLASSICAL CHEMICAL DYNAMIC SIMULATION OF H+HO۲ REACTION IN GAS PHASE
A theoretical study on the adsorption of hydrogen molecule on single-walled carbon nanotubes
reaction from furan by hydroxyl radical Theoretical studies on the hydrogen abstraction
Kinetic Study on the Pyrolysis of ۱,۲-Dichloroethane (EDC) in a FlowSystem
Arezoo Habibagahi A Theoretical Study on the Kinetics of the Reactions between Amino Radical and Hydroxyl Radical
A Theoretical Study On The Kinetics Of Hydrogen Abstraction Reaction Of Hydroxyl Radical With Hydrogen Sulfide And Ozonolysis Of Ethylene
A Kinetic Study on the Pyrolysis of Methyltrichlorosilane