Hassan Behnejad

Journal Paper

1. "Synthesis, analysis, and application of zinc oxide and bismuth-based nanocomposites (ZnO/BaBi2O6) as a photocatalyst for organic dyes degradation"
   Pouria Alaei Roozbahani, Hassan Behnejad, Majid Hamzeh Lo
   INORGANIC CHEMISTRY COMMUNICATIONS, Vol. 168, No 1, 2024
2. "Molecular dynamics simulation approach to explore mechanical properties of graphene-polyaniline hybrid sheets"
   Elnaz Mehrafrooz, Hassan Behnejad
   CURRENT APPLIED PHYSICS, Vol. 63, No 1, pp.56-65, 2024
3. "Salt-resistant hierarchically porous wood sponge coated with graphene flake/polyaniline nanocomposite for interfacial solar steam production and wastewater treatment"
   Masoomeh Shafaee, Elaheh goharshadi, Hassan Behnejad
   SOLAR ENERGY, Vol. 276, No 1, 2024
4. "A highly efficient and sustainable photoabsorber in solar-driven seawater desalination and wastewater purification"
   Masoomeh Shafaee, Elaheh goharshadi, Mohammad Mustafa Ghafurian, Mojtaba Mohammadi, Hassan Behnejad
   RSC Advances, Vol. 13, No 26, pp.17935-17946, 2023
5. "Comparing oxidation of aluminum by oxygen and ozone using reactive force field molecular dynamics simulations"
   Fateme Saidinik, Hassan Behnejad
   JOURNAL OF NANOPARTICLE RESEARCH, Vol. 25, No 5, 2023
6. "Crossover description of transport properties for some hydrocarbons in the supercritical region"
   Rambod Kaghazchi, Hassan Behnejad
   CHEMICAL PHYSICS LETTERS, Vol. 792, No 3, 2022
7. "Novel p–n–p heterojunction photocatalyst synthesized by BiFeO3, ZnO, and BiOBr nanoparticles: facile preparation and high photocatalytic activity under visible light"
   Niloufar Foghahazadeh, Hassan Behnejad, Mitra Mosavi, Majid Hamzeh Lo
   JOURNAL OF MATERIALS SCIENCE-MATERIALS IN ELECTRONICS, Vol. 39, 2020
8. "Using the Semiempirical Quantum Mechanics in Improving the Molecular Docking: A Case Study with CDK2"
   saleh bagheri, Hassan Behnejad, Roholla Firozi, Mohammad Hossein Karimi-jafari
   Molecular Informatics, Vol. 39, No 9, 2020
9. "Comparison of Two Types of Crossover Soave–Redlich–Kwong Equations of State for Derivative Properties of n-Alkanes"
   Vinhal Vinhal, Asma Jamali, Hassan Behnejad, Wei Yan, Georgios Kontogeorgis
   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, Vol. 59, No 19, pp.9265-9278, 2020
10. "Spectrophotometric-chemometrics study of the effect of solvent composition and temperature on the spectral shape and shift of copper and nickel phthalocyanines in different aqueous-nonaqueous mixed solvents"
    Sahar Moradian, Hamid Dezhampanah, Jahan Bakhsh Ghasemi, Hassan Behnejad
    SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, Vol. 227, No 1, 2020
11. "Exploring 3D-QSPR models of human skin permeability for a diverse dataset of chemical compounds"
    Soheila Rezaei, Hassan Behnejad, Fereshteh Shiri, Jahan Bakhsh Ghasemi
    JOURNAL OF RECEPTORS AND SIGNAL TRANSDUCTION, Vol. 22, No 1, pp.1-9, 2019
12. "Comparison of two crossover procedures for describing thermodynamic behavior of normal alkanes from singular critical to regular classical regions"
    Asma Jamali, Andre Vinhal, Hassan Behnejad, Wei Yan, Georgios Kontogeorgis
    DYNAMIC SYSTEMS AND APPLICATIONS, Vol. 495, No 1, pp.33-46, 2019
13. "Insight into the melting mechanism of Na19Li36, Na36Li19 and Na54K1 nanoalloys by molecular dynamics simulations"
    fatemeh Aryanfar, Raheleh Rostamian, Hassan Behnejad
    Journal of the Iranian Chemical Society, Vol. 16, No 11, pp.2351-2356, 2019
14. "Observations regarding the first and second order thermodynamic derivative properties of non-polar and light polar fluids by perturbed chain-SAFT equations of state"
    Asma Jamali, Hassan Behnejad
    CRYOGENICS, Vol. 99, No 1, pp.78-86, 2019
15. "How does graphene nanosheet affect the pharmaceutical adsorption? A comprehensive insight from molecular dynamics simulation, quantum mechanics and experimental study"
    Raheleh Rostamian, Negar Amiri, Hassan Behnejad
    JOURNAL OF MOLECULAR LIQUIDS, Vol. 269, No 1, pp.29-37, 2018
16. "Insights into doxycycline adsorption onto graphene nanosheet: a combined quantum mechanics, thermodynamics, and kinetic study"
    Rahele Rostamian, Hassan Behnejad
    Environmental Science and Pollution Research, Vol. 25, No 3, pp.2528-2537, 2018
17. "A comprehensive adsorption study and modeling of antibiotics as a pharmaceutical waste by graphene oxide nanosheets"
    Raheleh Rostamian, Hassan Behnejad
    ECOTOXICOLOGY AND ENVIRONMENTAL SAFETY, Vol. 147, No 1, pp.117-123, 2018
18. "Temperature influence on the structure and dynamics of polymers at the interface: Atomistic molecular dynamics simulation of atactic polystyrene nanoconfined between graphene surfaces"
    Ali Rafi Dargahi, Hassan Behnejad, Hosain Eslami
    JOURNAL OF MOLECULAR LIQUIDS, Vol. 244, No 1, pp.19-26, 2017
19. "A unified platform for experimental and quantum mechanical study of antibiotic removal from water"
    Rahele Rostamian, Hassan Behnejad
    Journal of Water Process Engineering, Vol. 17, No 1, pp.207-215, 2017
20. "Prediction of thermodynamic behavior of binary mixtures by applying the crossover approach to Soave–Redlich–Kwong equation of state"
    Hassan Behnejad, Cheshmpak Hashem
    Journal of the Iranian Chemical Society, Vol. 14, No 8, pp.1765-1775, 2017
21. "Molecular Dynamics Simulation of the Melting Process in Au15Ag40 Nanoalloys"
    Fatemeh Arianfar , Rahele Rostamian, Hassan Behnejad
    Physical Chemistry Research, Vol. 5, No 2, pp.359-366, 2017
22. "An analytical equation of state for ammonia at high temperatures and high pressures"
    Soran Jahangiri, Hassan Behnejad
    JOURNAL OF MOLECULAR LIQUIDS, Vol. 222, No 3, pp.733-738, 2016
23. "A comparative adsorption study of sulfamethoxazole onto graphene and graphene oxide nanosheets through equilibrium, kinetic and thermodynamic modeling"
    Raheleh Rostamian, Hassan Behnejad
    PROCESS SAFETY AND ENVIRONMENTAL PROTECTION, Vol. 102, No 3, pp.20-29, 2016
24. "Oxidation of nickel surfaces through the energetic impacts of oxygen molecules: Reactive molecular dynamics simulations"
    Negar Amiri, Hassan Behnejad
    JOURNAL OF CHEMICAL PHYSICS, Vol. 144, No 14, 2016
25. "Equilibrium and kinetic studies for the adsorption of benzene and toluene by graphene nanosheets: a comparison with carbon nanotubes"
    Mohammad Raad, Hassan Behnejad, Mouhiaddine El Jamal
    SURFACE AND INTERFACE ANALYSIS, Vol. 48, No 3, pp.117-125, 2016
26. "Isomorphic Viscosity Equation of State for Binary Fluid Mixtures"
    Hassan Behnejad, Hashem Cheshm, Asma Jamali
    ACTA CHIMICA SLOVENICA, Vol. 62, No 3, 2015
27. "Molecular dynamics simulation studies of p-xylene on graphene surface: effect of partial charge calculation method on adsorption energies"
    Mohammad Raad, Hassan Behnejad
    Journal of the Iranian Chemical Society, Vol. 12, No 11, pp.1999-2005, 2015
28. "Non-Isothermal Degradation Kinetics of High Energy Protons Irradiated Polyvinyl Butyral"
    Manoochehr Fatholahi, Hassan Behnejad, Muhammad Shadman
    Physical Chemistry Research, Vol. 3, No 3, pp.217-228, 2015
29. "A comparative study of thermal behaviors and kinetics analysis of the pyrotechnic compositions containing Mg and Al"
    Manochehr Fatholahi, Hassan Behnejad
    JOURNAL OF THERMAL ANALYSIS AND CALORIMETRY, Vol. 120, No 2, pp.1483-1492, 2015
30. "The Extended Crossover Peng–Robinson Equation of State for Describing the Thermodynamic Properties of Pure Fluids"
    Hassan Behnejad, Hashem Cheshm, Asma Jamali
    JOURNAL OF STATISTICAL PHYSICS, Vol. 158, No 2, pp.372-385, 2014
31. "Crossover parametric equation of state for asymmetric binary liquid system"
    Asma Jamali, Hassan Behnejad, Khaled Hosseini
    JOURNAL OF MOLECULAR LIQUIDS, Vol. 197, No 197, pp.93-99, 2014
32. "Non-Isothermal Degradation Kinetics of High Energy Protons Irradiated Polyvinyl"
    Manochehr Fatholahi, Hassan Behnejad, Muhammad Shademan
    Physical Chemistry Research, Vol. 3, No 3, pp.217-228, 2014
33. "Communication: Striking dependence of diffusion kinetics in Ag–Cu nanoalloys upon composition and quantum effects"
    Mehdi Asgari, Fabio R. Negreiros, Luca Sementa, Giovanni Barcaro, Hassan Behnejad, Alessandro Fortunelli
    JOURNAL OF CHEMICAL PHYSICS, Vol. 141, No 4, 2014
34. "Composition-dependent melting behaviour of Na K 55– core–shell nanoalloys"
    Mehdi Asgari, Hassan Behnejad, Alessandro Fortunelli
    MOLECULAR PHYSICS, Vol. 112, No 13, pp.1-12, 2014
35. "Prediction of transport properties of CO 2 –N 2 binary mixtures via the inversion of reduced-viscosity collision integrals"
    Tayebeh Hosseinnejad , Hassan Behnejad
    Russian Journal of Physical Chemistry B, Vol. 8, No 1, pp.58-68, 2014
36. "Thermodynamic properties of refrigerants from SM sound velocity-based equation of state"
    Mohammad Mehdi Alavianmehr, Hassan Behnejad, Soran Jahangiri, Seyed Mostafa Hosseini
    PHYSICS AND CHEMISTRY OF LIQUIDS, Vol. 52, No 4, pp.1-10, 2013
37. "Critical behaviour of thermo-physical properties in weakly compressible liquid mixtures"
    Asma Jamali, Hassan Behnejad
    PHYSICS AND CHEMISTRY OF LIQUIDS, Vol. 52, No 4, pp.1-14, 2013
38. "Potential energy function for HeS+ and transport properties of S+ in He"
    Amir Hossein Jalili, Hassan Behnejad, Ghazaleh Afsahi, Mahtab Gharibi, Larry Viehland
    CHEMICAL PHYSICS LETTERS, Vol. 584, No 584, pp.49-52, 2013
39. "System-dependent melting behavior of icosahedral anti-Mackay nanoalloys"
    Hassan Yousefi Oderji, Hassan Behnejad, Ricarrdo Ferrando, Hongbin Ding
    RSC Advances, Vol. 3, No 44, 2013
40. "Molecular dynamics simulation of the melting process in Ag27Cu13 core–shell nanoalloy"
    Mehdi Asgari, Hassan Behnejad
    CHEMICAL PHYSICS, Vol. 423, No 423, pp.36-42, 2013
41. "Crossover parametric equation of state for asymmetric fluids"
    Amin Bakhshandeh, Hassan Behnejad
    CHEMICAL PHYSICS, Vol. 409, No 3, pp.32-36, 2012
42. "A new scaled crossover parametric equation of state for water"
    Amin Bakhshandeh, Hassan Behnejad
    Journal of the Iranian Chemical Society, Vol. -, 2012
43. "Calculation of the second self - diffusion and viscosity virial coefficients of Lennard - Jones fluid by equilibrium molecular dynamics simulations"
    Hassan Yousefi Oderji , Hongbin Ding , Hassan Behnejad
    PHYSICAL REVIEW E, Vol. 83, No 6, 2011
44. "Determination of and interaction potentials from gaseous ion mobility data"
    Amir Hossein Jalili, Ali Abbaspour, Hassan Behnejad, Larry Viehland
    MOLECULAR PHYSICS, Vol. 108, No 1, pp.35-40, 2010
45. "Determination of Ar - O2 and Kr - O2 Interaction potential from gaseous Ion mobility data"
    امیر حسین جلیلی , علی عباسپور تمیجانی , Hassan Behnejad, ویلیام وایلند
    MOLECULAR PHYSICS, Vol. 108, No 1, pp.35-40, 2010
46. "Molecular dynamics simulation of liquid–vapor phase equilibria in polar fluids"
    Hossein Eslami , Ali Rafi Dargahi, Hassan Behnejad
    CHEMICAL PHYSICS LETTERS, Vol. 473, pp.66-71, 2009
47. "Theoretical investigation of imidazolium based ionic liquid/alcohol mixture: a molecular dynamic simulation"
    Hassan Behnejad, Soran Jahangiri, M Taghikhani
    MOLECULAR PHYSICS, Vol. 106, No 8, pp.1015-1023, 2008
48. "Viscosity and thermal conductivity of some refrigerants at moderate and high densities on the basis of Rainwater - Friend theory and the corresponding states principle"
    Tayebeh Hosseinnejad , Hassan Behnejad
    DYNAMIC SYSTEMS AND APPLICATIONS, Vol. 263, No 1, pp.85-95, 2008
49. "theoretical investigation of imidazolium based ionic / alchol mixture a molecular dynamic simulation"
    Soran Jahangiri , M Taghikhani , Hassan Behnejad, Seyyed Ahmadi
    MOLECULAR PHYSICS, Vol. 106, No 8, pp.1015-1023, 2007
50. "Calculation of hydrogen's thermal conductivity at moderate and high densities"
    Hassan Behnejad, A Pedram
    CHEMICAL PHYSICS, Vol. 325, pp.358-351, 2006
51. "Calculation of transport properties and intermolecular potential energy function of the binary mixtures of H2 with Ne, Ar, Kr and Xe by a semi - empirical inversion method"
    Tayebeh Hosseinnejad, Hassan Behnejad, وکیل حاتمی شهمیر
    DYNAMIC SYSTEMS AND APPLICATIONS, Vol. 258, No 2, pp.155-167, 2006
52. "Direct dtermination of pair potential energy function from extended law of corresponding states and calculation of thermophysical properties for H2 - He"
    Hassan Behnejad, Tayebeh Hosseinnejad , Vakil Hatami Shahmir , Fatemeh Arianfar
    CHEMICAL PHYSICS, Vol. 311, No 31, pp.253-245, 2005
53. "Initial density dependence of the viscosity of hydrogen and a corresponding states expression for high pressures"
    Hassan Behnejad, Ms Miralinaghi
    JOURNAL OF MOLECULAR LIQUIDS, Vol. 113, pp.148-143, 2004
54. "Topological analysis and quantum mechanical structure of H+3"
    A Sadjadi , M Abdzadeh , Hassan Behnejad
    JOURNAL OF CHEMICAL RESEARCH, Vol. -, No 5, pp.359-358, 2004
55. "On the Calculation of Viscosity Coefficients for H2 obeying Hartree - Fock Dispersion ( HFD ) - type Potential"
    B Haghighi , Hassan Behnejad
    JOURNAL OF THE CHEMICAL SOCIETY OF PAKISTAN, Vol. 23, pp.1-7, 2001
56. "Direct Determination of Intermolecular Potential for H2 - H2 from a Viscosity Correlation Equation"
    Ali Maghari , Hassan Behnejad, Farzin Negarestan
    JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN, Vol. 68, No 7, pp.2276-2280, 1999
57. "The concept of variable activation energy of the reaction and its relation to the starting temperature of solid-state reaction kinetics"
    Manochehr Fatholahi, Hassan Behnejad
    Applied Chemistry, Vol. 10, No 35, pp.87-102, 2015
58. "Thermal Kinetics and Combustion Characteristics of a New Multicomponent Nano-Al/MnO2/PTFE Pyrolant"
    Manochehr Fatholahi, Hassan Behnejad
    ENERGY, Vol. 9, No 3, pp.3-12, 2015

Conference Paper

1. "Near -Infrared- Sensitive Polymer Based on Upconverting Nanoparticles"
   Raheleh Rostamian, Hassan Behnejad, Hans-jurgen Butt
   19th Iranian Physical Chemistry Conference, 2016
2. "Crossover Carnhan starling equation of state"
   Hashem Cheshm, Hassan Behnejad, Asma Jamali Rafsanjani
   18th Iranian Physical Chemistry Conference, 2016
3. "A Comparative Thermodynamic Study of sulfonamide as An Antibiotic Adsorption onto Graphene and Graphene oxide Nanosheets"
   Rahele Rostamian, Hassan Behnejad
   18th Iranian Physical Chemistry Conference, 2016
4. "Investigating of the Dynamic Properties of Drug Adsorption onto Graphene Nanosheets"
   Raheleh Rostamian, Hassan Behnejad
   18th Iranian Physical Chemistry Conference, 2016
5. "Dehydration kinetics of a novel nano-porous swollen hydrogel as a carrier matrix for oral drug delivery systems"
   Saleh Bagheri, Fakhrpour G., Hassan Behnejad
   18th Iranian Physical Chemistry Conference, 2016
6. "Reactive molecular dynamic simulation of the Hyperthermal oxidation of Ni surfaces"
   Negar Amiri, Hassan Behnejad
   18th Iranian Physical Chemistry Conference, 2016
7. "Investigating of the dynamic properties of endohedral fullerenes (H2O@C60, H2S@C60, NH3@C60 ) using molecular dynamic simulations"
   Ehsan Jalali Bahram, Hassan Behnejad
   18th Iranian Physical Chemistry Conference, 2016
8. "Study of the Dynamical criteria of Na19Li36, Na36Li19 and Na54K1 Nanoalloys using Molecular Dynamics Simulations"
   Arianfar Fatemeh, Hassan Behnejad
   18th Iranian Physical Chemistry Conference, 2016
9. "Simplified Crossover SAFT Equation of State to description of supercritical thermodynamic and transport properties"
   Kaghazchi Rambod, Hassan Behnejad, Asma Jamali Rafsanjani
   18th Iranian Physical Chemistry Conference, 2016
10. "Theoretical Investigation on the Mechanism of Gas Phase Reaction between IrPt+ Ion and Methane Using Ab Initio and DFT Methods"
    Vahabi Y.s., Alireza Shayesteh, Hassan Behnejad
    18th Iranian Physical Chemistry Conference, 2016
11. "Development of a new crossover function based on Patel-Teja Equation of State"
    Zeinab Moeineslam, Majid Hamzeh Lo, Asma Jamali, Hassan Behnejad
    Iranian Physical Chemistry Conference University Of Mazandaran, 2013
12. "Crossover parametric equation of state for weakly compressible binary fluids"
    Asma Jamali, Khaled Hosseini, Hassan Behnejad
    Iranian Physical Chemistry Conference University Of Mazandaran, 2013
13. "A New Expression for the Crossover Function Crossover Peng Robinson Equation of State"
    Mohammad Reza Chehelamirani, Hassan Behnejad, Hoda Hadian
    Iranian Physical Chemistry Conference University Of Mazandaran, 2013
14. "Structural and Dynamical Properties of Nanoconfined Polystyrene Oligomers a Molecular Dynamics Study"
    Ali Rafi Dargahi, Hassan Behnejad, Hossein Eslami
    Iranian Physical Chemistry Conference University Of Mazandaran, 2013
15. "Thermal Degradation Kinetics of Un-Irradiated and High Energy Proton Irradiated Polyvinyl Butyral"
    Manoochehr Fathollahi, Muhammad Shadman, Hassan Behnejad
    26 th international symposium on Polymer Analysis and Characterization, 2013
16. "Molecular dynamic simulation of the melting process in Ag27-Cu13 core shell Nannoalloy"
    مهدی عسگری, Hassan Behnejad
    15th Iranian Physical Chemistry conference, 2012
17. "Non-isothermal degradation kinetics of Un-irradiated and High Energy Protons Irradiated Polyvinyl Butyral"
    منوچهر فتح الهی, Hassan Behnejad, mohamad shademan
    15th Iranian Physical Chemistry Conference, 2012
18. "Molecular Dynamic simulation of the melting process in Au15Ag40 Nanoalloy"
    فاطمه آریانفر, مهدی عسگری, Hassan Behnejad
    15th Iranian Physical Chemistry Conference, 2012
19. "Thermal properties and kinetic analysis of novel highly reactive material Nano versus micron composite"
    منوچهر فتح الهی, Hassan Behnejad, mohamad shademan
    15th Iranian Physical Chemistry Conference, 2012
20. "Mobility of gaseous ions in noble gases: comparison of potential models"
    Hassan Behnejad, امیرحسین جلیلی , غزاله افصحی, علی عباسپور, مهتاب غریبی, Larry Viehland
    15th Iranian Physical Chemistry Conference University of Tehran Tehran September3-6 2012, 2012
21. "Gaseous ion mobility of SO2 + ions in He and Ar"
    Afsahi Ghazaleh, Hassan Behnejad, Amir Hossein Jalili, Larry Viehland
    ESCAMPIG XXI, Viana do Castelo, Portugal, July 10-14 2012, 2012
22. "Transport properties of Ar-H2S plasma"
    Hassan Behnejad, Ghazaleh Afsahi, Amir Hossein Jalili
    14th Iranian Physical Chemistry Conference, 2011
23. "Crossover parametric equation of sate using complete scaling"
    Amin Bakhshandeh, Hassan Behnejad
    14th Iranian physical chemistry conference, 2011
24. "Thermodynamic Behavior of Fluids: Crossover from Ising-lik to Nonasymptotic Mean-Field Critical Behavior"
    Hassan Behnejad, امین بخشنده, Jan Sengers
    13th Iranian Physical Chemistry Conference, 2010
25. "Pridiction of the phase behavior of pure polar compounds"
    علی رفیع درگاهی, Hassan Behnejad
    12th Iranian Physical Chemistry Seminar, 2009
26. "Role of Electron Donors In MGCL2-Supported Zigler-Natta Catalysis"
    Hassan Behnejad, Faegheh Khoramifar, Amin Bakhshandeh
    Macro-and Supramolecular Architectures and Materials, 2008
27. "Validity of Rainwater-Friend Theory for Self Diffusion by using of Molecular Dynamics Simulation"
    Hassan Yousefi Oderji, Hassan Behnejad
    10th Iranian Physical Chemistry Conference, 2007
28. "Theoretical Investigation on Heterogeneous Ziegler-natta catalyst support"
    فایقه خرمی فر, امین بخشنده, Hassan Behnejad
    The 10th Iranian Physical chemistry Seminar, 2006
29. "Initial Density Dependence of the Hydrogen Thermal Conductivity and Corresponding States Correlation for High Denities"
    Hassan Behnejad, ا پدرام
    16th Symposium on Thermophysical Properties, 2006