A
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Abba, Hamza
Thermodynamics and Kinetics of Spiro-Heterocycle Formation Mechanism: Computational Study [Volume 5, Issue 3, 2017, Pages 439-446]
-
Achouri, Bilal
Theoretical Study on the Chemical Reactivity in the Armchair Single-walled Carbon Nanotube: Proton and Methyl Group Transfer [Volume 5, Issue 2, 2017, Pages 239-251]
-
Ahmadi, Mojtaba
Simultaneous Ash and Sulphur Removal from Bitumen Using Column Flotation Technique: Experiments, RSM Modeling and Optimization [Volume 5, Issue 1, 2017, Pages 195-204]
-
Ahmadi, Roya
Calculation of Thermodynamic Parameters of [2.4.6] Three Nitro Toluene (TNT) with Nanostructures of Fullerene and Boron Nitride Nano-cages over Different Temperatures, Using Density Functional Theory [Volume 5, Issue 4, 2017, Pages 617-627]
-
Ahmadzadeh, Hossein
Application of GMA Equation of State to Study Thermodynamic Properties of 2-Amino-2-methyl-1-propanol as an Efficient Absorbent for CO2 [Volume 5, Issue 2, 2017, Pages 317-328]
-
Ajloo, Davood
Spectroscopic, Thermodynamic and Molecular Docking Studies on Interaction of Toxic Azo Dye with Bovine Serum Albumin [Volume 5, Issue 3, 2017, Pages 541-554]
-
Akbartabar, Iman
Physical Chemistry Studies of Acid Dye Removal from Aqueous Media by Mesoporous Nano Composite: Adsorption Isotherm, Kinetic and Thermodynamic Studies [Volume 5, Issue 4, 2017, Pages 659-679]
-
Alimohammadi, Masoud
New Activated Carbon from Persian Mesquite Grain as an Excellent Adsorbent [Volume 5, Issue 1, 2017, Pages 81-98]
-
Almasi, Mohammad
Measurement of Selected Thermophysical and Viscosity of Binary Mixtures of Nitromethane with 2-Propanol, 2-Butanol and 2-Pentanol [Volume 5, Issue 1, 2017, Pages 13-24]
-
AnsariFard, Mohammad
Theoretical Investigation of the Reaction Mechanism for a Type of N-heterocyclic Compound Involving Mono-N-aryl-3-aminodihydropyrrol [Volume 5, Issue 4, 2017, Pages 755-769]
-
Arianfar, Fatemeh
Molecular Dynamics Simulation of the Melting Process in Au15Ag40 Nanoalloys [Volume 5, Issue 2, 2017, Pages 359-366]
-
Ashraf, Narges
Surfactant Effects on Tautomeric and Microscopic Equilibria of Tryptophan: Experimental and Theoretical Studies [Volume 5, Issue 1, 2017, Pages 25-39]
-
Atashi, Hossein
Two-level Full Factorial Design for Selectivity Modeling and Studying Simultaneous Effects of Temperature and Ethanol Concentration in Methanol Dehydration Reaction [Volume 5, Issue 1, 2017, Pages 41-56]
-
Atashi, Hossein
The Application of Hybrid RSM/ANN Methodology of an Iron-based Catalyst Performance in Fischer-Tropsch Synthesis [Volume 5, Issue 3, 2017, Pages 585-600]
-
Azizi, Zahra
Coordination and Siting of Cu+ Ion Adsorbed into Silicalite-2 Porous Structure: A Density Functional Theory Study [Volume 5, Issue 1, 2017, Pages 135-152]
-
Azizi Toupkanloo, Hossein
Molecular Dynamics Simulation of Al/NiO Thermite Reaction Using Reactive Force Field (ReaxFF) [Volume 5, Issue 2, 2017, Pages 221-237]
B
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Bagherinia, Mohammad Ali
Mean Activity Coefficients Measurements and Thermodynamic Modeling of the Ternary Mixed Electrolyte KCl + Lactose + Water System at T = 298.15 K [Volume 5, Issue 4, 2017, Pages 783-794]
-
Bahrpaima, khatereh
Effect of Magnetic Field on the Liquid-liquid Equilibria of (Water + Acetic Acid + Organic Solvent) Ternary Systems [Volume 5, Issue 1, 2017, Pages 125-134]
-
Bashiri, Hadis
Kinetic Monte Carlo Study of Biodiesel Production through Transesterification of Brassica Carinata Oil [Volume 5, Issue 2, 2017, Pages 329-338]
-
Behjatmanesh-Ardakani, Reza
The Effect of Cu Impurity on the CO-dissociation Mechanism on the Fe (100) Surface: A Full Potential DFT Study [Volume 5, Issue 4, 2017, Pages 831-839]
-
Behnejad, Hassan
Molecular Dynamics Simulation of the Melting Process in Au15Ag40 Nanoalloys [Volume 5, Issue 2, 2017, Pages 359-366]
-
Behzadi, Mehdi
Effect of Magnetic Field on the Liquid-liquid Equilibria of (Water + Acetic Acid + Organic Solvent) Ternary Systems [Volume 5, Issue 1, 2017, Pages 125-134]
-
Belmiloud, Yamina
Theoretical Study on the Chemical Reactivity in the Armchair Single-walled Carbon Nanotube: Proton and Methyl Group Transfer [Volume 5, Issue 2, 2017, Pages 239-251]
-
Bijanzadeh, Ali Reza
Effect of Magnetic Field on the Liquid-liquid Equilibria of (Water + Acetic Acid + Organic Solvent) Ternary Systems [Volume 5, Issue 1, 2017, Pages 125-134]
-
Binaei Ghotbabadi, Bahareh
Density and Polarization Profiles of Dipolar Hard Ellipsoids Confined between Hard Walls: A Density Functional Theory Approach [Volume 5, Issue 1, 2017, Pages 153-166]
-
Bordbar, Abdol-Khalegh
Putative Binding Sites of Dopamine and Arachidonoyl Dopamine to Beta-lactoglobulin: A Molecular Docking and Molecular Dynamics Study [Volume 5, Issue 2, 2017, Pages 205-219]
-
Bordbar, Gholam Hossein
Variational Calculations for the Relativistic Interacting Fermion System at Finite Temperature: Application to Liquid 3He [Volume 5, Issue 1, 2017, Pages 99-112]
-
Bozorgzadeh, Hamid Reza
Kinetic Model Study of Dry Reforming of Methane Using Cold Plasma [Volume 5, Issue 2, 2017, Pages 395-408]
-
Brahimi, Meziane
Theoretical Study on the Chemical Reactivity in the Armchair Single-walled Carbon Nanotube: Proton and Methyl Group Transfer [Volume 5, Issue 2, 2017, Pages 239-251]
E
-
Ebrahimikia, Maryam
Calculation of Thermodynamic Parameters of [2.4.6] Three Nitro Toluene (TNT) with Nanostructures of Fullerene and Boron Nitride Nano-cages over Different Temperatures, Using Density Functional Theory [Volume 5, Issue 4, 2017, Pages 617-627]
-
Elahifard, MohammadReza
The Effect of Cu Impurity on the CO-dissociation Mechanism on the Fe (100) Surface: A Full Potential DFT Study [Volume 5, Issue 4, 2017, Pages 831-839]
-
Emmanuel Olaoye, Oluwasegun
Conductometric Study of the Thermodynamics of Micellization of Sodium dodecylsulfate (SDS) in the Presence of Some Aromatic Ammonium Salts [Volume 5, Issue 3, 2017, Pages 531-540]
-
Entezari, Mohammad H.
Sono-synthesis of Novel Magnetic Nanocomposite (Ba-α-Bi2O3-γ-Fe2O3) for the Solar Mineralization of Amoxicillin in an Aqueous Solution [Volume 5, Issue 2, 2017, Pages 253-268]
-
Ershad-Langroudi, Amir
Enhanced Procedure for Fabrication of an Ultrahydrophobic Aluminum Alloy Surface using Fatty Acid Modifiers [Volume 5, Issue 2, 2017, Pages 339-357]
-
Eshghi, Fazlolah
Geometric and Electronic Structures of Vanadium Sub-nano Clusters, Vn (n = 2-5), and their Adsorption Complexes with CO and O2 Ligands: A DFT-NBO Study [Volume 5, Issue 3, 2017, Pages 601-615]
-
Esmaeilzadeh, Fereidun
Diesel Oil Upgradation by Ultrasound Irradiation: A Study on the Effects of Main Operational Parameters [Volume 5, Issue 4, 2017, Pages 691-707]
F
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Fallahah, Mehrdad
Enhanced Procedure for Fabrication of an Ultrahydrophobic Aluminum Alloy Surface using Fatty Acid Modifiers [Volume 5, Issue 2, 2017, Pages 339-357]
-
Farhangi, Marjan
Surfactant Effects on Tautomeric and Microscopic Equilibria of Tryptophan: Experimental and Theoretical Studies [Volume 5, Issue 1, 2017, Pages 25-39]
-
Farmanzadeh, Davood
The Length Dependent Activity of Oximes on Reactivation of Tabun Inhibited Acetylcholinesterase; A Theoretical Study [Volume 5, Issue 2, 2017, Pages 309-315]
-
Farsad, Maryam
The Effect of Cu Impurity on the CO-dissociation Mechanism on the Fe (100) Surface: A Full Potential DFT Study [Volume 5, Issue 4, 2017, Pages 831-839]
-
Farshchi Tabrizi, Farshad
Two-level Full Factorial Design for Selectivity Modeling and Studying Simultaneous Effects of Temperature and Ethanol Concentration in Methanol Dehydration Reaction [Volume 5, Issue 1, 2017, Pages 41-56]
-
Farzi, Nahid
Surface Tension Prediction of n-Alkanes by a Modified Peng-Robinson Equation of State Using the Density Functional Theory [Volume 5, Issue 3, 2017, Pages 569-583]
-
Fathollahi, Manoochehr
Molecular Dynamics Simulation of Al/NiO Thermite Reaction Using Reactive Force Field (ReaxFF) [Volume 5, Issue 2, 2017, Pages 221-237]
-
Fazeli, Morteza
Preparation and Characterization of a Novel Biodegradable Epoxy Resin Modified with Epoxidized Oleic Acid [Volume 5, Issue 4, 2017, Pages 629-641]
-
Fazeli, Seyed Morteza
Kinetic Model Study of Dry Reforming of Methane Using Cold Plasma [Volume 5, Issue 2, 2017, Pages 395-408]
-
Felrgari, Zahra
Adsorption Properties of Folic Acid onto Functionalized Carbon Nanotubes: Isotherms and Thermodynamics Studies [Volume 5, Issue 3, 2017, Pages 519-529]
-
Funso Olorunyomi, Joseph
Conductometric Study of the Thermodynamics of Micellization of Sodium dodecylsulfate (SDS) in the Presence of Some Aromatic Ammonium Salts [Volume 5, Issue 3, 2017, Pages 531-540]
G
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Ghambarian, Mehdi
Coordination and Siting of Cu+ Ion Adsorbed into Silicalite-2 Porous Structure: A Density Functional Theory Study [Volume 5, Issue 1, 2017, Pages 135-152]
-
Ghasemian Lemraski, Ensieh
New Activated Carbon from Persian Mesquite Grain as an Excellent Adsorbent [Volume 5, Issue 1, 2017, Pages 81-98]
-
Ghashghaee, Mohammad
Coordination and Siting of Cu+ Ion Adsorbed into Silicalite-2 Porous Structure: A Density Functional Theory Study [Volume 5, Issue 1, 2017, Pages 135-152]
-
Ghashghaee, Mohammad
Enhanced Procedure for Fabrication of an Ultrahydrophobic Aluminum Alloy Surface using Fatty Acid Modifiers [Volume 5, Issue 2, 2017, Pages 339-357]
-
Ghashghaee, Mohammad
Mechanism Discrimination for Bimolecular Reactions: Revisited with a Practical Hydrogenation Case Study [Volume 5, Issue 4, 2017, Pages 727-736]
-
Ghazizadeh, Ehsan
Empirical Potential Energy Curve for the Ground State of CaH from a Multi-isotopologue Direct Potential Fit Analysis [Volume 5, Issue 4, 2017, Pages 643-658]
-
Ghiasi, Mina
Quantum Mechanical Approach for the Catalytic Mechanism of Dinuclear Zinc Metallo-β-lactamase by Penicillin and Cephalexin: Kinetic and Thermodynamic Points of View [Volume 5, Issue 4, 2017, Pages 709-725]
-
Ghogomu, Julius Numbonui
A Density Functional Theory Investigation of d8 Transition Metal(II) (Ni, Pd, Pt) Chloride Complexes of Some Vic-dioximes Derivatives [Volume 5, Issue 4, 2017, Pages 737-754]
-
Ghogomu, Julius Numbonui
DFT Studies and Topological Analyses of Electron Density on Acetophenone and Propiophenone Thiosemicarbazone Derivatives as Covalent Inhibitors of Falcipain-2, a Major Plasmodium Falciparum Cysteine Protease [Volume 5, Issue 4, 2017, Pages 795-817]
-
Gholamhosseinzadeh, Mohammad Reza
Mentha spicata L. Extract as a Green Corrosion Inhibitor for Carbon Steel in HCl Solution [Volume 5, Issue 2, 2017, Pages 293-307]
-
Gholami, Samira
Putative Binding Sites of Dopamine and Arachidonoyl Dopamine to Beta-lactoglobulin: A Molecular Docking and Molecular Dynamics Study [Volume 5, Issue 2, 2017, Pages 205-219]
-
Ghorbanloo, Massomeh
pH Sensitive Hydrogel Based Acrylic Acid for Controlled Drug Release [Volume 5, Issue 1, 2017, Pages 185-193]
-
Ghows, Narjes
Sono-synthesis of Novel Magnetic Nanocomposite (Ba-α-Bi2O3-γ-Fe2O3) for the Solar Mineralization of Amoxicillin in an Aqueous Solution [Volume 5, Issue 2, 2017, Pages 253-268]
-
Goharshadi, Elaheh K.
Application of GMA Equation of State to Study Thermodynamic Properties of 2-Amino-2-methyl-1-propanol as an Efficient Absorbent for CO2 [Volume 5, Issue 2, 2017, Pages 317-328]
-
Golestani, Ghasem
Mentha spicata L. Extract as a Green Corrosion Inhibitor for Carbon Steel in HCl Solution [Volume 5, Issue 2, 2017, Pages 293-307]
-
Gordi, Zinat
Preparation and Characterization of a Novel Biodegradable Epoxy Resin Modified with Epoxidized Oleic Acid [Volume 5, Issue 4, 2017, Pages 629-641]
H
-
Habibi-khorassani, Sayeydmosatfa
Theoretical Investigation of the Reaction Mechanism for a Type of N-heterocyclic Compound Involving Mono-N-aryl-3-aminodihydropyrrol [Volume 5, Issue 4, 2017, Pages 755-769]
-
Hamedani, Shahla
Adsorption Properties of Folic Acid onto Functionalized Carbon Nanotubes: Isotherms and Thermodynamics Studies [Volume 5, Issue 3, 2017, Pages 519-529]
-
Hashemi Dashtaki, Seyedeh Leila
Chemical Kinetics for Reaction of 5-Nitro-1H-benzo[d]imidazole to Produce 6-Nitro-1H-benzo[d]imidazole and Calculation of Heat Capacity of Activation [Volume 5, Issue 3, 2017, Pages 409-424]
-
Hatami, Ali
Theoretical Investigation of the Reaction Mechanism for a Type of N-heterocyclic Compound Involving Mono-N-aryl-3-aminodihydropyrrol [Volume 5, Issue 4, 2017, Pages 755-769]
-
Heydari, Ali
pH Sensitive Hydrogel Based Acrylic Acid for Controlled Drug Release [Volume 5, Issue 1, 2017, Pages 185-193]
-
Honarmand, Mehrdad
Empirical Correlations and an Artificial Neural Network Approach to Estimate Saturated Vapor Pressure of Refrigerants [Volume 5, Issue 2, 2017, Pages 281-292]
-
Housaindokht, Mohammed Reza
Surfactant Effects on Tautomeric and Microscopic Equilibria of Tryptophan: Experimental and Theoretical Studies [Volume 5, Issue 1, 2017, Pages 25-39]
I
-
Idris, Sulaiman
Thermodynamics and Kinetics of Spiro-Heterocycle Formation Mechanism: Computational Study [Volume 5, Issue 3, 2017, Pages 439-446]
-
Izadyar, Mohammad
Selective Binding of Cyclic Nanopeptide with Halides and Ion Pairs; a DFT-D3 Study [Volume 5, Issue 3, 2017, Pages 425-437]
J
-
Jafari, Parisa
The Effect of pH on the Liquid-liquid Equilibrium for a System Containing Polyethylene Glycol Di-methyl Ether and Tri-potassium Citrate and its Application for Acetaminophen Separation [Volume 5, Issue 3, 2017, Pages 555-567]
-
Jahantab, Mahjobeh
Sensitivity of Perfect and Stone-Wales Defective BNNTs Toward NO Molecule: A DFT/M06-2X Approach [Volume 5, Issue 1, 2017, Pages 167-183]
-
Javanmardi, Jafar
A Fugacity Approach for Prediction of Phase Equilibria of Methane Clathrate Hydrate in Structure H [Volume 5, Issue 3, 2017, Pages 465-481]
-
Joshaghani, Mohammad
Simultaneous Ash and Sulphur Removal from Bitumen Using Column Flotation Technique: Experiments, RSM Modeling and Optimization [Volume 5, Issue 1, 2017, Pages 195-204]
K
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Karami, Bahador
Chemical Kinetics for Reaction of 5-Nitro-1H-benzo[d]imidazole to Produce 6-Nitro-1H-benzo[d]imidazole and Calculation of Heat Capacity of Activation [Volume 5, Issue 3, 2017, Pages 409-424]
-
Karami, Leila
Molecular Dynamics Simulation and Free Energy Studies on the Interaction of Salicylic Acid with Human Serum Albumin (HSA) [Volume 5, Issue 3, 2017, Pages 483-496]
-
Kassaee, Mohammad Zaman
N-Heterocyclic Plumbylenes (NHPbs) at Theoretical Levels [Volume 5, Issue 4, 2017, Pages 819-830]
-
Khanmohammadi, Azadeh
The Influence of Cation-π Interactions on the Strength and Nature of Intramolecular O...H Hydrogen Bond in Orthohydroxy Benzaldehyde Compound [Volume 5, Issue 1, 2017, Pages 57-68]
-
Khavani, Mohammad
Selective Binding of Cyclic Nanopeptide with Halides and Ion Pairs; a DFT-D3 Study [Volume 5, Issue 3, 2017, Pages 425-437]
M
-
Madadi Mahani, Nosrat
A First-Principles Study on Interaction between Carbon Nanotubes (10,10) and Gallates Derivatives as Vehicles for Drug Delivery [Volume 5, Issue 2, 2017, Pages 367-375]
-
Mahmoudi Ghalvandi, Maryam
The Effect of Substrate on Structural and Electrical Properties of Cu3N Thin Film by DC Reactive Magnetron Sputtering [Volume 5, Issue 3, 2017, Pages 497-504]
-
Majdan-Cegincara, Roghayeh
Modeling the Thermodynamic Properties of Solutions Containing Polymer and Electrolyte with New Local Composition Model [Volume 5, Issue 3, 2017, Pages 505-518]
-
Mama, Désiré Bikélé
A Density Functional Theory Investigation of d8 Transition Metal(II) (Ni, Pd, Pt) Chloride Complexes of Some Vic-dioximes Derivatives [Volume 5, Issue 4, 2017, Pages 737-754]
-
Meghdadi Isfahani, Amir Homayoon
Empirical Correlations and an Artificial Neural Network Approach to Estimate Saturated Vapor Pressure of Refrigerants [Volume 5, Issue 2, 2017, Pages 281-292]
-
Mirzaei, Ali Akbar
Two-level Full Factorial Design for Selectivity Modeling and Studying Simultaneous Effects of Temperature and Ethanol Concentration in Methanol Dehydration Reaction [Volume 5, Issue 1, 2017, Pages 41-56]
-
Mizani, S.
Variational Calculations for the Relativistic Interacting Fermion System at Finite Temperature: Application to Liquid 3He [Volume 5, Issue 1, 2017, Pages 99-112]
-
Mohammadi, Amir H.
A Fugacity Approach for Prediction of Phase Equilibria of Methane Clathrate Hydrate in Structure H [Volume 5, Issue 3, 2017, Pages 465-481]
-
Mohammadi, Marzyeh
Chemical Kinetics for Reaction of 5-Nitro-1H-benzo[d]imidazole to Produce 6-Nitro-1H-benzo[d]imidazole and Calculation of Heat Capacity of Activation [Volume 5, Issue 3, 2017, Pages 409-424]
-
Mohammadian-Abriz, Ali
Modeling the Thermodynamic Properties of Solutions Containing Polymer and Electrolyte with New Local Composition Model [Volume 5, Issue 3, 2017, Pages 505-518]
-
Mohammadi Sabet, M. T.
Variational Calculations for the Relativistic Interacting Fermion System at Finite Temperature: Application to Liquid 3He [Volume 5, Issue 1, 2017, Pages 99-112]
-
Mohebi, Nazanin
N-Heterocyclic Plumbylenes (NHPbs) at Theoretical Levels [Volume 5, Issue 4, 2017, Pages 819-830]
-
Monhemi, Hassan
Surfactant Effects on Tautomeric and Microscopic Equilibria of Tryptophan: Experimental and Theoretical Studies [Volume 5, Issue 1, 2017, Pages 25-39]
-
Moradi, Mahmood
Density and Polarization Profiles of Dipolar Hard Ellipsoids Confined between Hard Walls: A Density Functional Theory Approach [Volume 5, Issue 1, 2017, Pages 153-166]
-
Moradmand Jalali, Hamed
Kinetic Monte Carlo Simulation of Oxalic Acid Ozonationover Lanthanum-based Perovskitesas Catalysts [Volume 5, Issue 1, 2017, Pages 1-11]
-
Mowla, Dariush
Diesel Oil Upgradation by Ultrasound Irradiation: A Study on the Effects of Main Operational Parameters [Volume 5, Issue 4, 2017, Pages 691-707]
N
-
Naderi, Shabnam
Application of GMA Equation of State to Study Thermodynamic Properties of 2-Amino-2-methyl-1-propanol as an Efficient Absorbent for CO2 [Volume 5, Issue 2, 2017, Pages 317-328]
-
Narouei, Simin
Theoretical Investigation of the Reaction Mechanism for a Type of N-heterocyclic Compound Involving Mono-N-aryl-3-aminodihydropyrrol [Volume 5, Issue 4, 2017, Pages 755-769]
-
Nasirizadeh, Navid
Physical Chemistry Studies of Acid Dye Removal from Aqueous Media by Mesoporous Nano Composite: Adsorption Isotherm, Kinetic and Thermodynamic Studies [Volume 5, Issue 4, 2017, Pages 659-679]
-
Nassaj Gerowgi, Zeinab
Measurement of Thermophysical Properties of Pure and Mixture of Alkanolamines from 288.15-323.15 K [Volume 5, Issue 2, 2017, Pages 269-279]
-
Nkungli, Nyiang Kennet
A Density Functional Theory Investigation of d8 Transition Metal(II) (Ni, Pd, Pt) Chloride Complexes of Some Vic-dioximes Derivatives [Volume 5, Issue 4, 2017, Pages 737-754]
-
Nkungli, Nyiang Kennet
DFT Studies and Topological Analyses of Electron Density on Acetophenone and Propiophenone Thiosemicarbazone Derivatives as Covalent Inhibitors of Falcipain-2, a Major Plasmodium Falciparum Cysteine Protease [Volume 5, Issue 4, 2017, Pages 795-817]
-
Nogheu, Ludovid Ngouo
A Density Functional Theory Investigation of d8 Transition Metal(II) (Ni, Pd, Pt) Chloride Complexes of Some Vic-dioximes Derivatives [Volume 5, Issue 4, 2017, Pages 737-754]
-
Noohi, Bahare
Quantum Mechanical Approach for the Catalytic Mechanism of Dinuclear Zinc Metallo-β-lactamase by Penicillin and Cephalexin: Kinetic and Thermodynamic Points of View [Volume 5, Issue 4, 2017, Pages 709-725]
-
Norouzi, Nazanin Zahra
Mean Activity Coefficients Measurements and Thermodynamic Modeling of the Ternary Mixed Electrolyte KCl + Lactose + Water System at T = 298.15 K [Volume 5, Issue 4, 2017, Pages 783-794]
-
Noura, Mehdi
Hydrogen Adsorption on (5,0) and (3,3) Na-decorated BNNTs [Volume 5, Issue 3, 2017, Pages 447-463]
O
-
Owoyomi, Olanrewaju
Conductometric Study of the Thermodynamics of Micellization of Sodium dodecylsulfate (SDS) in the Presence of Some Aromatic Ammonium Salts [Volume 5, Issue 3, 2017, Pages 531-540]
P
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Pakiari, Ali Haidar
Geometric and Electronic Structures of Vanadium Sub-nano Clusters, Vn (n = 2-5), and their Adsorption Complexes with CO and O2 Ligands: A DFT-NBO Study [Volume 5, Issue 3, 2017, Pages 601-615]
-
Parvini, Elahe
Ab Initio Studies on the Interplay between Unconventional B•••X Halogen Bond and Lithium/Hydrogen/Halogen Bond in HB(CO)2•••XCN•••YF (X = Cl, Br; Y = Li, H, Cl) Complexes [Volume 5, Issue 4, 2017, Pages 771-781]
-
Pourbeiram, Nastaran
Kinetic Monte Carlo Study of Biodiesel Production through Transesterification of Brassica Carinata Oil [Volume 5, Issue 2, 2017, Pages 329-338]
R
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Rabiee, Ahmad
Enhanced Procedure for Fabrication of an Ultrahydrophobic Aluminum Alloy Surface using Fatty Acid Modifiers [Volume 5, Issue 2, 2017, Pages 339-357]
-
Rafee, Vahdat
The Effect of Substrate on Structural and Electrical Properties of Cu3N Thin Film by DC Reactive Magnetron Sputtering [Volume 5, Issue 3, 2017, Pages 497-504]
-
Rafiee, Marjan A.
Antimalarial Activity of some Conjugated Arylhydrazones: Ab Initio Calculation of Nuclear Quadrupole Coupling Constants (NQCC) [Volume 5, Issue 4, 2017, Pages 681-689]
-
Rahbarian, Rahele
Preparation and Characterization of a Novel Biodegradable Epoxy Resin Modified with Epoxidized Oleic Acid [Volume 5, Issue 4, 2017, Pages 629-641]
-
Raissi, Marziyeh
Study the Interaction of Ni Complex of Tetradentate Schiff Base Ligand with HEN Egg White Lysozyme [Volume 5, Issue 1, 2017, Pages 113-123]
-
Ramandi, Sara
Sono-synthesis of Novel Magnetic Nanocomposite (Ba-α-Bi2O3-γ-Fe2O3) for the Solar Mineralization of Amoxicillin in an Aqueous Solution [Volume 5, Issue 2, 2017, Pages 253-268]
-
Ramazani, Shapour
Chemical Kinetics for Reaction of 5-Nitro-1H-benzo[d]imidazole to Produce 6-Nitro-1H-benzo[d]imidazole and Calculation of Heat Capacity of Activation [Volume 5, Issue 3, 2017, Pages 409-424]
-
Rasouli, Nahid
Study the Interaction of Ni Complex of Tetradentate Schiff Base Ligand with HEN Egg White Lysozyme [Volume 5, Issue 1, 2017, Pages 113-123]
-
Rasouli, Nahid
Spectroscopic, Thermodynamic and Molecular Docking Studies on Interaction of Toxic Azo Dye with Bovine Serum Albumin [Volume 5, Issue 3, 2017, Pages 541-554]
-
Ravari, Fatemeh
The Influence of Cation-π Interactions on the Strength and Nature of Intramolecular O...H Hydrogen Bond in Orthohydroxy Benzaldehyde Compound [Volume 5, Issue 1, 2017, Pages 57-68]
-
Ravari, Fatemeh
Kinetic Model Study of Dry Reforming of Methane Using Cold Plasma [Volume 5, Issue 2, 2017, Pages 395-408]
-
Ravari, Fatemeh
Preparation and Characterization of a Novel Biodegradable Epoxy Resin Modified with Epoxidized Oleic Acid [Volume 5, Issue 4, 2017, Pages 629-641]
-
Razavizadeh, Seyed Ahmad
An Improved Correlation for Second Virial Coefficients of Pure Fluids [Volume 5, Issue 1, 2017, Pages 69-79]
-
Razavizadeh, Seyed Ahmad
Measurement of Thermophysical Properties of Pure and Mixture of Alkanolamines from 288.15-323.15 K [Volume 5, Issue 2, 2017, Pages 269-279]
-
Razeghizadeh, Alireza
The Effect of Substrate on Structural and Electrical Properties of Cu3N Thin Film by DC Reactive Magnetron Sputtering [Volume 5, Issue 3, 2017, Pages 497-504]
-
Razmjooie, Afshin
The Application of Hybrid RSM/ANN Methodology of an Iron-based Catalyst Performance in Fischer-Tropsch Synthesis [Volume 5, Issue 3, 2017, Pages 585-600]
-
Reiszadeh, Mehdi
Empirical Correlations and an Artificial Neural Network Approach to Estimate Saturated Vapor Pressure of Refrigerants [Volume 5, Issue 2, 2017, Pages 281-292]
-
Rezainejad, Hamid
The Length Dependent Activity of Oximes on Reactivation of Tabun Inhibited Acetylcholinesterase; A Theoretical Study [Volume 5, Issue 2, 2017, Pages 309-315]
-
Rezvani, Naficea
Spectroscopic, Thermodynamic and Molecular Docking Studies on Interaction of Toxic Azo Dye with Bovine Serum Albumin [Volume 5, Issue 3, 2017, Pages 541-554]
-
Roohi, Hossein
Sensitivity of Perfect and Stone-Wales Defective BNNTs Toward NO Molecule: A DFT/M06-2X Approach [Volume 5, Issue 1, 2017, Pages 167-183]
-
Roosta, Aliakbar
A Fugacity Approach for Prediction of Phase Equilibria of Methane Clathrate Hydrate in Structure H [Volume 5, Issue 3, 2017, Pages 465-481]
-
Rostamian, Raheleh
Molecular Dynamics Simulation of the Melting Process in Au15Ag40 Nanoalloys [Volume 5, Issue 2, 2017, Pages 359-366]
-
Rouhbakhsh Zaeri, Zeinab
Surfactant Effects on Tautomeric and Microscopic Equilibria of Tryptophan: Experimental and Theoretical Studies [Volume 5, Issue 1, 2017, Pages 25-39]
S
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Saboury, Ali Akbar
Molecular Dynamics Simulation and Free Energy Studies on the Interaction of Salicylic Acid with Human Serum Albumin (HSA) [Volume 5, Issue 3, 2017, Pages 483-496]
-
Sadeghzadeh Ahari, Jafar
Kinetic Model Study of Dry Reforming of Methane Using Cold Plasma [Volume 5, Issue 2, 2017, Pages 395-408]
-
Saedi, Leila
Ab Initio Studies on the Interplay between Unconventional B•••X Halogen Bond and Lithium/Hydrogen/Halogen Bond in HB(CO)2•••XCN•••YF (X = Cl, Br; Y = Li, H, Cl) Complexes [Volume 5, Issue 4, 2017, Pages 771-781]
-
Shafiei Gol, Heydar Ali
Hydrogen Adsorption on (5,0) and (3,3) Na-decorated BNNTs [Volume 5, Issue 3, 2017, Pages 447-463]
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Shahidi Zandi, Mehdi
Mentha spicata L. Extract as a Green Corrosion Inhibitor for Carbon Steel in HCl Solution [Volume 5, Issue 2, 2017, Pages 293-307]
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Shahraki, Farhad
The Application of Hybrid RSM/ANN Methodology of an Iron-based Catalyst Performance in Fischer-Tropsch Synthesis [Volume 5, Issue 3, 2017, Pages 585-600]
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Shahraki, Mehdi
Theoretical Investigation of the Reaction Mechanism for a Type of N-heterocyclic Compound Involving Mono-N-aryl-3-aminodihydropyrrol [Volume 5, Issue 4, 2017, Pages 755-769]
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Shamseddini, Arash
Diesel Oil Upgradation by Ultrasound Irradiation: A Study on the Effects of Main Operational Parameters [Volume 5, Issue 4, 2017, Pages 691-707]
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Sharafinia, Soheila
New Activated Carbon from Persian Mesquite Grain as an Excellent Adsorbent [Volume 5, Issue 1, 2017, Pages 81-98]
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Shayesteh, Alireza
Empirical Potential Energy Curve for the Ground State of CaH from a Multi-isotopologue Direct Potential Fit Analysis [Volume 5, Issue 4, 2017, Pages 643-658]
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Sheikh, Setareh
Measurement of Thermophysical Properties of Pure and Mixture of Alkanolamines from 288.15-323.15 K [Volume 5, Issue 2, 2017, Pages 269-279]
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Shekaari, Hemayat
The Effect of pH on the Liquid-liquid Equilibrium for a System Containing Polyethylene Glycol Di-methyl Ether and Tri-potassium Citrate and its Application for Acetaminophen Separation [Volume 5, Issue 3, 2017, Pages 555-567]
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Shirvani, Samira
Mechanism Discrimination for Bimolecular Reactions: Revisited with a Practical Hydrogenation Case Study [Volume 5, Issue 4, 2017, Pages 727-736]
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Shoghi Toosi, Monireh
Preparation and Characterization of a Novel Biodegradable Epoxy Resin Modified with Epoxidized Oleic Acid [Volume 5, Issue 4, 2017, Pages 629-641]
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Siaka, Abdulfatai Adabara
Thermodynamics and Kinetics of Spiro-Heterocycle Formation Mechanism: Computational Study [Volume 5, Issue 3, 2017, Pages 439-446]
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Sinehbaghizadeh, Saeed
A Fugacity Approach for Prediction of Phase Equilibria of Methane Clathrate Hydrate in Structure H [Volume 5, Issue 3, 2017, Pages 465-481]
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Sohillian, Farhang
The Effect of Substrate on Structural and Electrical Properties of Cu3N Thin Film by DC Reactive Magnetron Sputtering [Volume 5, Issue 3, 2017, Pages 497-504]
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Sohrabi, Nasrin -
Study the Interaction of Ni Complex of Tetradentate Schiff Base Ligand with HEN Egg White Lysozyme [Volume 5, Issue 1, 2017, Pages 113-123]
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Sohrabi, Nasrin
Spectroscopic, Thermodynamic and Molecular Docking Studies on Interaction of Toxic Azo Dye with Bovine Serum Albumin [Volume 5, Issue 3, 2017, Pages 541-554]
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Tayebi, Habib-Allah
Physical Chemistry Studies of Acid Dye Removal from Aqueous Media by Mesoporous Nano Composite: Adsorption Isotherm, Kinetic and Thermodynamic Studies [Volume 5, Issue 4, 2017, Pages 659-679]
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Tazikeh-Lemeski, Elham
Molecular Dynamics Simulation and Free Energy Studies on the Interaction of Salicylic Acid with Human Serum Albumin (HSA) [Volume 5, Issue 3, 2017, Pages 483-496]
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Uzairu, Adamu
Thermodynamics and Kinetics of Spiro-Heterocycle Formation Mechanism: Computational Study [Volume 5, Issue 3, 2017, Pages 439-446]
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Vasseghian, Yasser
Simultaneous Ash and Sulphur Removal from Bitumen Using Column Flotation Technique: Experiments, RSM Modeling and Optimization [Volume 5, Issue 1, 2017, Pages 195-204]
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Vatanparast, Morteza
Ab Initio Studies on the Interplay between Unconventional B•••X Halogen Bond and Lithium/Hydrogen/Halogen Bond in HB(CO)2•••XCN•••YF (X = Cl, Br; Y = Li, H, Cl) Complexes [Volume 5, Issue 4, 2017, Pages 771-781]
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Waried, Hussein
Modulation Response and Relative Intensity Noise Spectra in Quantum Cascade Lasers [Volume 5, Issue 2, 2017, Pages 377-394]
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Yaghoubi Koupaye, Somaye
Empirical Correlations and an Artificial Neural Network Approach to Estimate Saturated Vapor Pressure of Refrigerants [Volume 5, Issue 2, 2017, Pages 281-292]
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Yazdanshenas, Mohammad Esmail
Physical Chemistry Studies of Acid Dye Removal from Aqueous Media by Mesoporous Nano Composite: Adsorption Isotherm, Kinetic and Thermodynamic Studies [Volume 5, Issue 4, 2017, Pages 659-679]
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Yazdanshenas, Zakieh
Surface Tension Prediction of n-Alkanes by a Modified Peng-Robinson Equation of State Using the Density Functional Theory [Volume 5, Issue 3, 2017, Pages 569-583]
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Younang, Elie
A Density Functional Theory Investigation of d8 Transition Metal(II) (Ni, Pd, Pt) Chloride Complexes of Some Vic-dioximes Derivatives [Volume 5, Issue 4, 2017, Pages 737-754]
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Zafarani-Moattar, Mohammed T.
The Effect of pH on the Liquid-liquid Equilibrium for a System Containing Polyethylene Glycol Di-methyl Ether and Tri-potassium Citrate and its Application for Acetaminophen Separation [Volume 5, Issue 3, 2017, Pages 555-567]
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Zahedi, Mansour
Quantum Mechanical Approach for the Catalytic Mechanism of Dinuclear Zinc Metallo-β-lactamase by Penicillin and Cephalexin: Kinetic and Thermodynamic Points of View [Volume 5, Issue 4, 2017, Pages 709-725]
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Zohdi-Fasaei, Hossein
Two-level Full Factorial Design for Selectivity Modeling and Studying Simultaneous Effects of Temperature and Ethanol Concentration in Methanol Dehydration Reaction [Volume 5, Issue 1, 2017, Pages 41-56]
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