Author Index

A

  • Abbasian, Ahmad Reza Hydrothermal synthesis of monoclinic - cubic Li2TiO3 hybrid nanocomposite microspheres [Volume 6, Issue 1, 2019, Pages 58-65]
  • Abdolmanafi, Arezou Study of B12N12 and AlB11N12 fullerene as H2S absorbent and sensor by computational method [Volume 2, Issue 1, 2015, Pages 178-172]
  • Abedini Khorrami, Saeed Effects of Calcination Temperature on the Synthesis, Chemical Structure, and Magnetic Properties of Nano Crystallites Zinc Ferrite Prepared by Combination of Sol-Gel Auto-Combustion and Ultrasonic Irradiation Techniques [Volume 5, Issue 4, 2018, Pages 584-592]
  • Afshar, Maryam Initial studies of the effects of halogenated dispersions on the amount of NICS compound ring 1- (4-fluorophenyl) -2,3-dihydro-1 H-naphtho [1 and 2-e] [1 and 3] oxazin-3-one [Volume 4, Issue 1, 2017, Pages 13-17]
  • Ahmadaghaei, Nastaran ADSORPTION OF PYRIDINE BY USING BeO NANOTUBE: A DFT STUDY [Volume 1, Issue 2, 2014, Pages 77-84]
  • Ahmadaghaei, Nastaran Pyrrole detection by BeO nanotube: DFT studies [Volume 1, Issue 3, 2014, Pages 134-144]
  • Ahmadi, Faride Investigating the Effect of Changes of Halogenated Compounds on the Aromaticity Flow (NICS) of Rings 5-fluorophenyl-1, 3, 7, 9-tetra methylpyrido [2,3] [d-5,6 dipyrimidine -2, 4, 6 and 8 tetron [Volume 4, Issue 1, 2017, Pages 7-12]
  • Ahmadi, Farideh Theoretical Study of effect ligands on Molecular & Orbital Properties of Cu complexes of industrial dyes formazan [Volume 3, Issue 1, 2016, Pages 7-12]
  • Ahmadi, Roya First Princiles Study of the Electron Transport Properties of Buthane-dithiol Nano-Molecular Wire [Volume 1, Issue 1, 2014, Pages 10-21]
  • Ahmadi, Roya The Study of Substituent effect on Osmabenzene complexes [Volume 1, Issue 1, 2014, Pages 30-40]
  • Ahmadi, Roya Investigation of Chemical Properties in Fullerene Derivatives of Fluoxetine Drug : A DFT Study [Volume 1, Issue 4, 2014, Pages 152-160]
  • Ahmadi, Roya The effect of Glutamine on conductivity and energetic properties in Graphene: A DFT studies [Volume 1, Issue 4, 2014, Pages 166-171]
  • Ahmadi, Roya Synthesis, Characterization, and Application of Zr,Ce-TiO2/SiO2 Nanocomposite Thin Film as Visible-light Active Photocatalyst [Volume 2, Issue 1, 2015, Pages 187-179]
  • Ahmadi, Roya Computational study of Chemical properties in fullerene Derivatives of Enalapril drug [Volume 2, Issue 1, 2015, Pages 198-189]
  • Ahmadi, Roya Investigation of Adsorption Enthalpy of Prolin on the Surface of Graphene with and without Si: A DFT Study [Volume 2, Issue 3, 2015, Pages 223-227]
  • Ahmadi, Roya Investigation of Chemical Properties in Fullerene Derivatives of Atenolol Drug: A DFT Study [Volume 2, Issue 3, 2015, Pages 228-233]
  • Ahmadi, Roya The thermodynamic parameters derived material [1,5-b] tetrazolo [1,2,4] Terry inflorescences (TTA) with boron nitride nano- cages in different conditions of temperature , density functional theory method. [Volume 2, Issue 4, 2015, Pages 247-254]
  • Ahmadi, Roya Density Functional Theory Study of the Behavior of Carbon Nano cone, BP Nano cone and CSi Nano cone as Nano Carriers for 5-Fluorouracil Anticancer Drug in Water [Volume 4, Issue 3, 2017, Pages 111-116]
  • Ahmadi, Roya Investigating the Complexation of a recently synthesized phenothiazine with Different Metals by Density Functional Theory [Volume 4, Issue 4, 2017, Pages 400-408]
  • Ahmadi, Roya Evaluating the Performance of 2,3-dihydro-1H-phenothiazine-4(5aH)-one as an Ionophore in Construction of a Cation Selective Electrode by Density Functional Theory [Volume 5, Issue 1, 2018, Pages 409-418]
  • Ahmadi, Roya The Energetic, Check of Derived Boron Nitride Nano- cage with (HMX) in Different Conditions of Temperature by Density Functional Theory Method [Volume 5, Issue 1, 2018, Pages 435-441]
  • Ahmadi, Zeinab A theoretical study about Substituted effect in current ring and aromaticity with NICS index in nano carrier Xylometazoline drug [Volume 3, Issue 1, 2016, Pages 20-25]
  • Akbari, Rahman The Assessment of Perceived Risk of Chemical-related Illness Among Inhabitant Community Adjacent to an Industrial Unit [Volume 6, Issue 4, 2019, Pages 224-235]
  • Alah Karam, Laleh Theoretical study of chemical properties of Fulleromethyldopa and derivatives [Volume 5, Issue 1, 2018, Pages 442-448]
  • Alzahar, Fatima Investigation of high-energy heterocyclic synthesis as a green fuel from the reaction of 3,6-D-aminotrazine with nitric acid and sodium azid; under different temperature conditions, by DFT method [Volume 4, Issue 4, 2017, Pages 409-415]
  • Amani Saghezchi, Sima A theoretical study of dipole moments, energy levels and structural parameters in the Oxymetazoline drug as a nano carrier based on fullerene with changing substitution [Volume 3, Issue 1, 2016, Pages 13-19]
  • Amini, Majed In-Situ Polymerization of UHMWPE Using Bi-Supported Ziegler-Natta Catalyst of MoS2 Oxide/MgCl2 (Ethoxide Type)/TiCl4/TiBA: Study of Thermo-Mechanical Properties of System [Volume 6, Issue 2, 2019, Pages 87-108]
  • Aminian, Omid Computational Investigation of the Effect of Changes in Halogenated on Factors in Nano-Carriers of 1-cyclohexyl-1-phenyl-3-pyrrolidin-1-yl-propan-1-ol hydrochloride and C60 [Volume 3, Issue 4, 2016, Pages 124-130]
  • Anaraki-Ardakani, Hossein An efficient one-pot synthesis of dimethyl 1-(Aryl)-5-cyano-4-(cyclohexylamino)-1,2,5,6-tetrahydro-6-oxopyridine-2,3-dicarboxylate derivatives [Volume 1, Issue 2, 2014, Pages 60-67]
  • Anaraki-Ardakani, Hossein NaHSO4–SiO2 Promoted Solvent-Free Synthesis of Triazolo [1,2-a]indazole-triones [Volume 1, Issue 3, 2014, Pages 108-114]
  • AP, Arumugam Cytotoxic and anticancer studies of an oxygen and nitrogen donor novel Schiff base ligand and its copper (II) complex [Volume 6, Issue 1, 2019, Pages 1-13]
  • Arastehnodeh, Ali Optimization of Enaminone structures and investigation of substituent effects on molecular stability using HF and DFT soft computational methods [Volume 5, Issue 2, 2018, Pages 476-486]
  • Aryayinejad, Nooshafarin Computational study of Chemical properties in fullerene Derivatives of (RS)-1-[4-(2-Methoxyethyl)phenoxy]-3-[(propan-2-yl)amino]propan-2-ol or Lopressor [Volume 3, Issue 3, 2016, Pages 103-108]
  • Asgar, Leila Surface adsorption of carbon monoxide and hydrogen gases mixed with boron nitride (7 ,7) nanotubes by Monte Carlo method [Volume 4, Issue 4, 2017, Pages 416-422]
  • Azadi doureh, Sedigheh The AIM, NBO thermodynamic, and quantum study of the interaction nitramide molecule with pristine, B, As and B&As doped of AlNNTs [Volume 6, Issue 2, 2019, Pages 109-132]
  • Azmayesh, S Theoretical insight of substituent effect in para substituted Fe(CO)4–pyridine complexes [Volume 1, Issue 2, 2014, Pages 85-96]

B

  • Babaie, Mahdi Reaction between Thiouracil derivatives and Chloroasetic acid in gas and soluble phases:A theoretical study [Volume 6, Issue 3, 2019, Pages 178-189]
  • Bagheri, Mahnaz Determination of Amitriptyline using Bromate-Bromide and two Dyes [Volume 1, Issue 1, 2014, Pages 41-50]
  • Bagheri, Mahnaz Complexation of a Catecholamine with Zinc (II) in Media with Different Dielectric Constants [Volume 1, Issue 3, 2014, Pages 126-133]
  • Bagheri Gh, Azar Determination of Amitriptyline using Bromate-Bromide and two Dyes [Volume 1, Issue 1, 2014, Pages 41-50]
  • Bagheri Gh, Azar Complexation of a Catecholamine with Zinc (II) in Media with Different Dielectric Constants [Volume 1, Issue 3, 2014, Pages 126-133]
  • Bakhshi-Homaldinraviz, Sajjad An efficient one-pot synthesis of dimethyl 1-(Aryl)-5-cyano-4-(cyclohexylamino)-1,2,5,6-tetrahydro-6-oxopyridine-2,3-dicarboxylate derivatives [Volume 1, Issue 2, 2014, Pages 60-67]
  • Banjo, Lily Computational Investigation of the Efference of Different Fullerenes on Aktogen High Energy [Volume 3, Issue 4, 2016, Pages 145-151]
  • Bari, Reza Experimental Study of Nitrate Absorption Isotherms Determination on Latium Composite Overactive Carbon [Volume 2, Issue 4, 2015, Pages 239-246]
  • Barmala, Molood Investigating the Effect of Nano Technology on Increasing Utilization in Oil Tanks and Wells in Upstream Industries [Volume 6, Issue 4, 2019, Pages 289-298]
  • Batebi, Arezo Quantum Mechanic Studies of Natural Bond Orbital & Stabilities of [CuCH2SiMe3]4Complexes With Different Halogens [Volume 3, Issue 1, 2016, Pages 1-6]
  • Beiraghi, Asadollah Selective Separation and Preconcentration of trace Amounts of Gallium in Water and Rice Samples using Cloud Point Extraction and Determination by Inductively Coupled Plasma-Atomic Emission Spectrometry [Volume 5, Issue 3, 2018, Pages 534-549]
  • Beiraghi, Asadollah Separation, Preconcentration and determination of Hg (II) Ion in Water Samples by Cloud Point Extraction Technique Coupled with UV-VIS Spectrophotometry using a New Complexing Agent [Volume 6, Issue 3, 2019, Pages 163-177]
  • Bodaghi-Namileh, Vida Design of Novel Drugs (P3TZ, H2P3TZ, M2P3TZ, H4P3TZ and M4P3TZ) Based on Zonisamide for Autism Treatment by Binding to Potassium Voltage-gated Channel Subfamily D Member 2 (Kv4.2) [Volume 6, Issue 4, 2019, Pages 254-276]
  • Boroushaki, Tahereh The Effect of B12N12 Substitution on the Properties of TEX Energetic Materials in Different Temperature Conditions: A DFT Study [Volume 5, Issue 1, 2018, Pages 427-434]
  • Boroushaki, Tahereh The Energetic, Check of Derived Boron Nitride Nano- cage with (HMX) in Different Conditions of Temperature by Density Functional Theory Method [Volume 5, Issue 1, 2018, Pages 435-441]

C

  • Casgrande, Salvador The study of electron-orbital properties of bipolar energy of complex (2,6-diaminopyridinium bis (4-hydroxy-pyridine-2,6,6-dicarboxylate) dihydrate chromate III))) with alteration of ligands by computational methods [Volume 4, Issue 2, 2017, Pages 53-59]
  • Collins, David Comparison of Stability Cu(C7H3NO4)2 and Valance / Charge Ratio of Oxygen and Carbon atoms in the Complex by Changing the Vinyl, Acetylene, isopropil [Volume 4, Issue 2, 2017, Pages 60-66]

D

  • Daghighi Asl, M Theoretical insight of substituent effect in para substituted Fe(CO)4–pyridine complexes [Volume 1, Issue 2, 2014, Pages 85-96]
  • Darouneh, Ehsan Biofertilizer production from gas refinery wastewater [Volume 5, Issue 3, 2018, Pages 493-499]
  • Darouneh, Ehsan The Lime and Flocculant Dose Optimization in the Clarification Process of a Sugar Factory [Volume 6, Issue 3, 2019, Pages 151-155]
  • Darvish Ganji, Masoud First Princiles Study of the Electron Transport Properties of Buthane-dithiol Nano-Molecular Wire [Volume 1, Issue 1, 2014, Pages 10-21]
  • Dastpak, Mahsa Investigating the resonance energy and charge transfer in the clonidine and c60-clonidine-fullerene carriers with quantum chemistry calculations [Volume 3, Issue 2, 2016, Pages 43-48]
  • Dehdari, Behnaz Pyrrole detection by BeO nanotube: DFT studies [Volume 1, Issue 3, 2014, Pages 134-144]
  • Dejene, Meaza Determination of Selected Pesticide Residues from Gilgel Gibe (I) Hydroelectric Dam Reservoir and Its Tributaries, Jimma Zone, Ethiopia [(Articles in Press)]

E

  • Ebadola, Shima Aniline adsorption on the surface of a BN nanotube: A Computational study [Volume 1, Issue 1, 2014, Pages 1-9]
  • Ebrahimikia, Maryam ADSORPTION OF PYRIDINE BY USING BeO NANOTUBE: A DFT STUDY [Volume 1, Issue 2, 2014, Pages 77-84]
  • Ebrahimikia, Maryam Pyrrole detection by BeO nanotube: DFT studies [Volume 1, Issue 3, 2014, Pages 134-144]
  • Ezzati, Mehdi The Effect of B12N12 Substitution on the Properties of TEX Energetic Materials in Different Temperature Conditions: A DFT Study [Volume 5, Issue 1, 2018, Pages 427-434]
  • Ezzati, Mehdi The Energetic, Check of Derived Boron Nitride Nano- cage with (HMX) in Different Conditions of Temperature by Density Functional Theory Method [Volume 5, Issue 1, 2018, Pages 435-441]

F

  • Faraji, Rahim A DFT Investigation on The Reaction of tetrazolo [1,5-b][1,2,4]triazine with 1,5-diaminotetrazole and glyoxal in Different Temperatures [Volume 6, Issue 2, 2019, Pages 133-142]
  • Faravar, Amir An empirical technique for prediction of nucleation mechanism and interfacial tension of potassium chloride nanoparticles [Volume 6, Issue 1, 2019, Pages 43-57]
  • Farhang, Behnam The Energetic, Check of Derived Boron Nitride Nano- cage with (HMX) in Different Conditions of Temperature by Density Functional Theory Method [Volume 5, Issue 1, 2018, Pages 435-441]
  • Farkhani, Dariush Nitration Ortho Dihydroxyl Benzene (Catechol) Using Bismuth Nitrate on the Solid Phase Montmorillonite [Volume 2, Issue 3, 2015, Pages 234-238]
  • Fathahiyan, Leila A DFT Investigation on The Reaction of tetrazolo [1,5-b][1,2,4]triazine with 1,5-diaminotetrazole and glyoxal in Different Temperatures [Volume 6, Issue 2, 2019, Pages 133-142]
  • Firoozeh, Marjan Quantum chemistry studies on reactivity of the 2-Amino-3-(3,4-Dihydroxyphenyl)Propanoic Aciddrug linked to to C60 [Volume 3, Issue 2, 2016, Pages 70-75]

G

  • Ghaemizadeh, Mojgan Adsorption of ethanol by using BN nanotube: a DFT study [Volume 1, Issue 1, 2014, Pages 22-29]
  • Ghaempanah, Aram Investigation of Nickle nanoclusters properties by density functional theory [Volume 5, Issue 4, 2018, Pages 600-609]
  • Ghaempanah, Aram Reaction between Thiouracil derivatives and Chloroasetic acid in gas and soluble phases:A theoretical study [Volume 6, Issue 3, 2019, Pages 178-189]
  • Ghaleh Ghobadi, Masumeh Experimental Study of Nitrate Absorption Isotherms Determination on Latium Composite Overactive Carbon [Volume 2, Issue 4, 2015, Pages 239-246]
  • Ghiasi, R Theoretical insight of substituent effect in para substituted Fe(CO)4–pyridine complexes [Volume 1, Issue 2, 2014, Pages 85-96]
  • Ghiasi, Reza The Study of Substituent effect on Osmabenzene complexes [Volume 1, Issue 1, 2014, Pages 30-40]
  • Gholipour, Mohammad Amin Initial study of the effect of substrates on Tetrahydrozoline and its nano-constituent drugs [Volume 3, Issue 2, 2016, Pages 49-55]
  • Godarzi, Maryam A DFT Investigation on The Reaction of tetrazolo [1,5-b][1,2,4]triazine with 1,5-diaminotetrazole and glyoxal in Different Temperatures [Volume 6, Issue 2, 2019, Pages 133-142]
  • Govindan, Elango Cytotoxic and anticancer studies of an oxygen and nitrogen donor novel Schiff base ligand and its copper (II) complex [Volume 6, Issue 1, 2019, Pages 1-13]
  • Gure, Abera Determination of Selected Pesticide Residues from Gilgel Gibe (I) Hydroelectric Dam Reservoir and Its Tributaries, Jimma Zone, Ethiopia [(Articles in Press)]

H

  • Haji Jafargholi, Asal Pyrrole adsorption on the surface of a BN nanotube: A Computational study [Volume 1, Issue 2, 2014, Pages 68-76]
  • Hajizadeh, Neda The Synthesis of 2, 6 diamino- 3, 5-dinitropyridine from Direct Nitration Reaction of 2, 6 diamino pyridine in Different Temperature Conditions by Density Functional Theory [Volume 5, Issue 2, 2018, Pages 449-456]
  • Hajizadeh, Neda The synthesis of 5- picrylamino-1, 2, 3, 4-tetrazole (PAT) from the reaction of 5-amino-1, 2, 3, 4-tetrazole with picryl chloride in different temperature conditions, the DFT method [Volume 5, Issue 2, 2018, Pages 457-465]
  • Hajizadeh, Neda Determination of Magnesium (II) by a Coated Graphite Electrode Based on Risperidone as an Ionophore [Volume 6, Issue 3, 2019, Pages 198-214]
  • Hamnabard, Zohreh Hydrothermal synthesis of monoclinic - cubic Li2TiO3 hybrid nanocomposite microspheres [Volume 6, Issue 1, 2019, Pages 58-65]
  • Hedayati Saghavaz, Bahare A simple method for the recovery of selenium from copper anode slime sample using alkaline roasting process [Volume 6, Issue 2, 2019, Pages 143-150]
  • Hegin, Elshadi PREPARATION AND CHARACTERIZATION OF TiO2 Fe2O3 NANOCOMPOSITE BY SOL GEL METHOD [Volume 5, Issue 4, 2018, Pages 593-599]
  • Helmi, Maryam The investigation of pyrocatechol electrochemical mechanism in presence of nitrite ion on platinum electrode [Volume 2, Issue 2, 2015, Pages 207-212]
  • Heydari, Zahra The Study of Dissolution Boric Acid in Different Temperatures: A DFT study [Volume 5, Issue 4, 2018, Pages 550-557]

I

  • Islam, Mohammad Jahidul The Prediction of Thermo Physical, Vibrational Spectroscopy, Chemical Reactivity, Biological Properties of Morpholinium Borate, Phosphate, Chloride and Bromide Ionic Liquid: A DFT Study [Volume 6, Issue 4, 2019, Pages 236-253]

J

  • Jafari, Masoumeh The Synthesis of Imine from the Reaction of (R)-2-((piperidin-1-yl) methyl) cyclohexanone with benzylamine in Different Temperature Conditions by DFT method [Volume 5, Issue 2, 2018, Pages 466-475]
  • Jafari, Masoumeh Evaluating the Thermodynamic Parameters the Derivative [b-5,1] tetrazolo [4,2,1] teriazine (TTA) with Boron nitride nano-cage in Different Temperature Conditions by DFT Method [Volume 5, Issue 3, 2018, Pages 500-512]
  • Jalalifard, Maryam Comparison of structural parameters in antiparkinson's drug: Procyclidine & its nano carrier based on fullerene with calculation chemistry [Volume 3, Issue 1, 2016, Pages 26-33]
  • Jalali Sarvestani, Mohammad Reza Investigating the Complexation of a recently synthesized phenothiazine with Different Metals by Density Functional Theory [Volume 4, Issue 4, 2017, Pages 400-408]
  • Jalali Sarvestani, Mohammad Reza Evaluating the Performance of 2,3-dihydro-1H-phenothiazine-4(5aH)-one as an Ionophore in Construction of a Cation Selective Electrode by Density Functional Theory [Volume 5, Issue 1, 2018, Pages 409-418]
  • Jalali Sarvestani, Mohammad Reza The Effect of B12N12 Substitution on the Properties of TEX Energetic Materials in Different Temperature Conditions: A DFT Study [Volume 5, Issue 1, 2018, Pages 427-434]
  • Jalili, Arya Computational Investigation on the Effect of Changes in Halogenated on Afrin with Fullerene [Volume 3, Issue 3, 2016, Pages 118-123]
  • Jamalvandi, Rohallah Evaluation of the Effect of Changes in Halogenated Compounds on NICS of Promethazine [Volume 3, Issue 4, 2016, Pages 131-136]

K

  • Kalateh, Khadijeh The Effect of Si Substitution on Distribution of H2 on Coronene [Volume 1, Issue 4, 2014, Pages 161-165]
  • Kalateh, Khadijeh Study of B12N12 and AlB11N12 fullerene as H2S absorbent and sensor by computational method [Volume 2, Issue 1, 2015, Pages 178-172]
  • Kalateh, Khadijeh A DFT study of the nuclear magnetic properties of fullerenes [Volume 2, Issue 2, 2015, Pages 213-222]
  • Kalhor, Masoumeh ADSORPTION OF PYRIDINE BY USING BeO NANOTUBE: A DFT STUDY [Volume 1, Issue 2, 2014, Pages 77-84]
  • Kanganizadeh, Pegah The Effect of Si Substitution on Distribution of H2 on Coronene [Volume 1, Issue 4, 2014, Pages 161-165]
  • Karimi, Saeed Computational Survey on the Effect of Changes in Halogenated Compounds on the structural properties in Chlorpromazine [Volume 3, Issue 1, 2016, Pages 34-42]
  • Kedir, Kassim Determination of Selected Pesticide Residues from Gilgel Gibe (I) Hydroelectric Dam Reservoir and Its Tributaries, Jimma Zone, Ethiopia [(Articles in Press)]
  • Ketabi, Speideh Comparison of doped combination zirconium-tungsten, zirconium- molybdenum and molybdenum-tungsten on single-wall vanadium oxide nanotube in hydrogen gas adsorption [Volume 4, Issue 3, 2017, Pages 100-110]
  • Khaled, Ahmad Investigating the Effect of Changes of Halogenated Compounds on the Aromaticity Flow (NICS) of Composite Rings 5-fluorophenyl-1, 3, 7, 9-tetra methylpyrido [2,3-: d [d-5,6 dipyrimidine -2, 4, 6 and 8 tetron [Volume 4, Issue 1, 2017, Pages 18-23]
  • Kheirollahpoor, Sara A DFT study of the nuclear magnetic properties of fullerenes [Volume 2, Issue 2, 2015, Pages 213-222]
  • Kheradmand, Amanj In-Situ Polymerization of UHMWPE Using Bi-Supported Ziegler-Natta Catalyst of MoS2 Oxide/MgCl2 (Ethoxide Type)/TiCl4/TiBA: Study of Thermo-Mechanical Properties of System [Volume 6, Issue 2, 2019, Pages 87-108]
  • Khoshnoodi, Masoomeh Nitration Ortho Dihydroxyl Benzene (Catechol) Using Bismuth Nitrate on the Solid Phase Montmorillonite [Volume 2, Issue 3, 2015, Pages 234-238]
  • Kiya Karimi Raja, Mohamad Investigation of Adsorption Enthalpy of Prolin on the Surface of Graphene with and without Si: A DFT Study [Volume 2, Issue 3, 2015, Pages 223-227]
  • Kohi, Mehdi Synthesis, Characterization, and Application of Zr,Ce-TiO2/SiO2 Nanocomposite Thin Film as Visible-light Active Photocatalyst [Volume 2, Issue 1, 2015, Pages 187-179]
  • Kopaiee Malek, Somaieh Quantum Mechanic Studies of Natural Bond Orbital & Stabilities of [CuCH2SiMe3]4Complexes With Different Halogens [Volume 3, Issue 1, 2016, Pages 1-6]
  • Kumer, Ajoy The Prediction of Thermo Physical, Vibrational Spectroscopy, Chemical Reactivity, Biological Properties of Morpholinium Borate, Phosphate, Chloride and Bromide Ionic Liquid: A DFT Study [Volume 6, Issue 4, 2019, Pages 236-253]
  • Kupta, Duddukuru Investigation of Thermodynamics of its 3-Butadiene Monomeric Derivatives with Nanoparticles of Fullerenes, Nanotubes and Nano Cones at Room Temperature by DFT Method [Volume 4, Issue 3, 2017, Pages 126-133]

L

  • Larit, Mehmet Study of the Effect of Halogens on the Asymmetric Parameters, Coating Constants and Chemical Disposition of Carbon Atoms in the C17H2ON2S Compound with Quantum Chemistry Calculations [Volume 3, Issue 4, 2016, Pages 152-157]
  • Lgaz, Helen Investigating the Energy Efficiency of TEX High Energy Derivatives with Different Carbon Fuller Nano Structures under Different Temperature Conditions by DFT Method [Volume 3, Issue 4, 2016, Pages 137-144]

M

  • Madadi Mahani, Nosrat Quantum chemical study of Interaction of PLGA polymeric nanoparticles as drug delivery with anti-cancer agents of thiazoline [Volume 6, Issue 1, 2019, Pages 34-42]
  • Maddah Zadeh Darini, Nastaran Investigation of Chemical Properties in Fullerene Derivatives of Atenolol Drug: A DFT Study [Volume 2, Issue 3, 2015, Pages 228-233]
  • Mahmoudzadeh, golrokh Effects of Calcination Temperature on the Synthesis, Chemical Structure, and Magnetic Properties of Nano Crystallites Zinc Ferrite Prepared by Combination of Sol-Gel Auto-Combustion and Ultrasonic Irradiation Techniques [Volume 5, Issue 4, 2018, Pages 584-592]
  • Mahmoudzadeh, Golrokh A Computational Study to Find the Vibrational Modes Connected with Specific Molecular Structures of Calculated Compound [Volume 6, Issue 4, 2019, Pages 277-288]
  • Makkipour, P Theoretical insight of substituent effect in para substituted Fe(CO)4–pyridine complexes [Volume 1, Issue 2, 2014, Pages 85-96]
  • Maleki, Shohreh Computational Computation of the Efferene Structure on the Para phenylene diamine [Volume 4, Issue 2, 2017, Pages 67-72]
  • Manoochehri, Mahboobeh Removal of toxic Cr(VI) ions from water sample a novel magnetic graphene oxide nanocomposite [(Articles in Press)]
  • Manteghian, Mehrdad An empirical technique for prediction of nucleation mechanism and interfacial tension of potassium chloride nanoparticles [Volume 6, Issue 1, 2019, Pages 43-57]
  • Masoumi, Masoomeh A simple method for the recovery of selenium from copper anode slime sample using alkaline roasting process [Volume 6, Issue 2, 2019, Pages 143-150]
  • Mazloomifar, Ali The investigation of pyrocatechol electrochemical mechanism in presence of nitrite ion on platinum electrode [Volume 2, Issue 2, 2015, Pages 207-212]
  • Mehrara, Sharzad Computational study of structures and electronic properties of the Catapres on nano structure of fullerene with calculations method [Volume 3, Issue 3, 2016, Pages 82-87]
  • Meshkinnejad, Fatemeh Methyl acetylene detection by BN nanotube: DFT studies [Volume 1, Issue 3, 2014, Pages 97-107]
  • Meshkinnezhad, Fatemeh Ethyl acetylene adsorption on the surface of a BN nanotube: A Computational study [Volume 1, Issue 2, 2014, Pages 51-59]
  • Mirkamali, Elaheh Sadat The effect of Glutamine on conductivity and energetic properties in Graphene: A DFT studies [Volume 1, Issue 4, 2014, Pages 166-171]
  • MirKamali, Elaheh Sadat The Energetic, Check of Derived Boron Nitride Nano- cage with (HMX) in Different Conditions of Temperature by Density Functional Theory Method [Volume 5, Issue 1, 2018, Pages 435-441]
  • Moalla, Ali Ethyl acetylene adsorption on the surface of a BN nanotube: A Computational study [Volume 1, Issue 2, 2014, Pages 51-59]
  • Moalla, Ali Methyl acetylene detection by BN nanotube: DFT studies [Volume 1, Issue 3, 2014, Pages 97-107]
  • Moeinian, Shahab A DFT Investigation on The Reaction of tetrazolo [1,5-b][1,2,4]triazine with 1,5-diaminotetrazole and glyoxal in Different Temperatures [Volume 6, Issue 2, 2019, Pages 133-142]
  • Moghadasi, Saeedeh Theoretical study of the properties of adenine amino acid tetomers with C60 [Volume 3, Issue 3, 2016, Pages 97-102]
  • Mohammadian, Zahra Effect of support nature on performance and kinetics of nickel nanoparticles in toluene hydrogenation [Volume 6, Issue 1, 2019, Pages 23-33]
  • Mohammadi Zeydi, Masoud γ-Fe2O3@KSF: A recyclable catalyst for the efficient synthesis of pyrano-pyrimidinone derivatives [Volume 5, Issue 4, 2018, Pages 570-583]
  • Mohasseb, Azar Adsorption of Tetryl on the Surface of Carbon Nanocone: A Theoretical Investigation [Volume 6, Issue 4, 2019, Pages 215-223]
  • Moradi, Peyman Experimental Study of Nitrate Absorption Isotherms Determination on Latium Composite Overactive Carbon [Volume 2, Issue 4, 2015, Pages 239-246]
  • Mosavari, Nader Reaction between Thiouracil derivatives and Chloroasetic acid in gas and soluble phases:A theoretical study [Volume 6, Issue 3, 2019, Pages 178-189]
  • Murugesan, M.Sathiya Investigation of dibromo and N-bromoacetyl derivatives of [b] carbazole-synthesis and antibacterial evaluation [Volume 6, Issue 2, 2019, Pages 66-75]

N

  • Nabati, Mehdi Design of Novel Drugs (P3TZ, H2P3TZ, M2P3TZ, H4P3TZ and M4P3TZ) Based on Zonisamide for Autism Treatment by Binding to Potassium Voltage-gated Channel Subfamily D Member 2 (Kv4.2) [Volume 6, Issue 4, 2019, Pages 254-276]
  • Najafpour, Jamshid Study of Nitro Factor Dislodgement in Fox-7 [Volume 2, Issue 2, 2015, Pages 199-206]
  • Najafpour, Jamshid Comparison of doped combination zirconium-tungsten, zirconium- molybdenum and molybdenum-tungsten on single-wall vanadium oxide nanotube in hydrogen gas adsorption [Volume 4, Issue 3, 2017, Pages 100-110]
  • Nasiri Moghaddam, Tahereh sadat Density Functional Theory Study of the Behavior of Carbon Nano cone, BP Nano cone and CSi Nano cone as Nano Carriers for 5-Fluorouracil Anticancer Drug in Water [Volume 4, Issue 3, 2017, Pages 111-116]
  • Nasrolah Kalantari, Ashkan A DFT Investigation on The Reaction of tetrazolo [1,5-b][1,2,4]triazine with 1,5-diaminotetrazole and glyoxal in Different Temperatures [Volume 6, Issue 2, 2019, Pages 133-142]
  • Nguyen, Vinod Comparison of Hartree Factor and Density Function Theory in Calculating Coating Constants and NMR Parameters of Chromate and Molecular Complexes with Alanine and Glycine [Volume 4, Issue 1, 2017, Pages 24-35]
  • Niakan, Neda Initial studies of the effects of halogenated dispersions on the amount of NICS of rings for C8H12XNO2 [Volume 4, Issue 1, 2017, Pages 1-6]
  • Nikandish, Shohreh Ab Initio study on nano carrier (RS)-2-(1,2,3,4- tetrahydronaphthalen -1-yl)-4,5-dihydro-1H-imidazol drug about Substituted effect in energy levels, dipole moment and structural parameters [Volume 3, Issue 3, 2016, Pages 109-117]
  • Nikmaram, Farrokh Roya The Effect of Si Substitution on Distribution of H2 on Coronene [Volume 1, Issue 4, 2014, Pages 161-165]
  • Nikmaram, Farrokh Roya Study of Nitro Factor Dislodgement in Fox-7 [Volume 2, Issue 2, 2015, Pages 199-206]
  • Nikmaram, Farrokh Roya Density Functional Theory Study of the Behavior of Carbon Nano cone, BP Nano cone and CSi Nano cone as Nano Carriers for 5-Fluorouracil Anticancer Drug in Water [Volume 4, Issue 3, 2017, Pages 111-116]
  • Noei, Maziar Aniline adsorption on the surface of a BN nanotube: A Computational study [Volume 1, Issue 1, 2014, Pages 1-9]
  • Noei, Maziar Adsorption of ethanol by using BN nanotube: a DFT study [Volume 1, Issue 1, 2014, Pages 22-29]
  • Noei, Maziar Ethyl acetylene adsorption on the surface of a BN nanotube: A Computational study [Volume 1, Issue 2, 2014, Pages 51-59]
  • Noei, Maziar Pyrrole adsorption on the surface of a BN nanotube: A Computational study [Volume 1, Issue 2, 2014, Pages 68-76]
  • Noei, Maziar ADSORPTION OF PYRIDINE BY USING BeO NANOTUBE: A DFT STUDY [Volume 1, Issue 2, 2014, Pages 77-84]
  • Noei, Maziar Methyl acetylene detection by BN nanotube: DFT studies [Volume 1, Issue 3, 2014, Pages 97-107]
  • Noei, Maziar Hydroquinone detection by BN nanotube: DFT studies [Volume 1, Issue 3, 2014, Pages 115-125]
  • Noei, Maziar Pyrrole detection by BeO nanotube: DFT studies [Volume 1, Issue 3, 2014, Pages 134-144]
  • Noormohammadi, Mohammad Investigating the Effect of Nano Technology on Increasing Utilization in Oil Tanks and Wells in Upstream Industries [Volume 6, Issue 4, 2019, Pages 289-298]

P

  • Pakdel, Zahra A Comparative Study of the Carbonyl Positioning Mechanism in the Mn (CO) 5 CH2F and Mn (CO) 5CHF2 Complex through Quantum Chemistry [Volume 4, Issue 4, 2017, Pages 423-431]
  • Pakdel, Zahra Computational Investigation of Carbonyl Positioning Mechanism in Mn (CO) 5CH2F Complex by Functional Density Theory [Volume 4, Issue 4, 2017, Pages 432-439]
  • Parsa, Ali The investigation of pyrocatechol electrochemical mechanism in presence of nitrite ion on platinum electrode [Volume 2, Issue 2, 2015, Pages 207-212]
  • Parsafard, Nastaran Effect of support nature on performance and kinetics of nickel nanoparticles in toluene hydrogenation [Volume 6, Issue 1, 2019, Pages 23-33]
  • Pasdar, Hoda A simple method for the recovery of selenium from copper anode slime sample using alkaline roasting process [Volume 6, Issue 2, 2019, Pages 143-150]
  • Paul, Sunanda The Prediction of Thermo Physical, Vibrational Spectroscopy, Chemical Reactivity, Biological Properties of Morpholinium Borate, Phosphate, Chloride and Bromide Ionic Liquid: A DFT Study [Volume 6, Issue 4, 2019, Pages 236-253]
  • Peyrovi, Mohammad Hasan Effect of support nature on performance and kinetics of nickel nanoparticles in toluene hydrogenation [Volume 6, Issue 1, 2019, Pages 23-33]
  • Pirahan Foroush, Mandana Theoretical study of chemical properties of Fulleromethyldopa and derivatives [Volume 5, Issue 1, 2018, Pages 442-448]
  • Pirhooshyaran, Tahereh The Lime and Flocculant Dose Optimization in the Clarification Process of a Sugar Factory [Volume 6, Issue 3, 2019, Pages 151-155]
  • Pourkarim, Somayeh Computational Study of the Mass, volume and Surface Effects on the Energetic Properties of RDX derivatives with Different Fullerenes (C20, C24 and C60) [Volume 5, Issue 1, 2018, Pages 419-426]

R

  • Rahimipour, Mohammad Reza Hydrothermal synthesis of monoclinic - cubic Li2TiO3 hybrid nanocomposite microspheres [Volume 6, Issue 1, 2019, Pages 58-65]
  • Ramazani S.A, Ahmad In-Situ Polymerization of UHMWPE Using Bi-Supported Ziegler-Natta Catalyst of MoS2 Oxide/MgCl2 (Ethoxide Type)/TiCl4/TiBA: Study of Thermo-Mechanical Properties of System [Volume 6, Issue 2, 2019, Pages 87-108]
  • Rezaei, Meysam Synthesis of Liner Alkyl-benzene Sulfonate Nanoparticle Using Green Promoter and High Efficiency [Volume 6, Issue 2, 2019, Pages 76-86]
  • Rezaei, Meysam A New Formula for Calculating the Viscosity of Base Oil and Polyisobutene Expensive Polymer for Lubricants [(Articles in Press)]
  • Rezaei Sameti, Mahdi The AIM, NBO thermodynamic, and quantum study of the interaction nitramide molecule with pristine, B, As and B&As doped of AlNNTs [Volume 6, Issue 2, 2019, Pages 109-132]
  • Rezaie Asl, Alireza Computational study of Chemical properties in fullerene Derivatives of Enalapril drug [Volume 2, Issue 1, 2015, Pages 198-189]
  • Roshdi, Mina Selective Separation and Preconcentration of trace Amounts of Gallium in Water and Rice Samples using Cloud Point Extraction and Determination by Inductively Coupled Plasma-Atomic Emission Spectrometry [Volume 5, Issue 3, 2018, Pages 534-549]

S

  • Saadat, Azade The synthesis of 5- picrylamino-1, 2, 3, 4-tetrazole (PAT) from the reaction of 5-amino-1, 2, 3, 4-tetrazole with picryl chloride in different temperature conditions, the DFT method [Volume 5, Issue 2, 2018, Pages 457-465]
  • Saberiyan Sani, Maryam Negar The Assessment of Perceived Risk of Chemical-related Illness Among Inhabitant Community Adjacent to an Industrial Unit [Volume 6, Issue 4, 2019, Pages 224-235]
  • SABERIYAN SANI, MARYAM NEGAR Study on the Effect of Rainfall Level on the Size of Silver Nanoparticles Synthesized by Plants of the Lamiaceae Family in Different Regions of Iran [Volume 5, Issue 3, 2018, Pages 513-522]
  • Saghi, Majid Optimization of Enaminone structures and investigation of substituent effects on molecular stability using HF and DFT soft computational methods [Volume 5, Issue 2, 2018, Pages 476-486]
  • Salari, Ali Akbar Aniline adsorption on the surface of a BN nanotube: A Computational study [Volume 1, Issue 1, 2014, Pages 1-9]
  • Salari, Ali Akbar Pyrrole adsorption on the surface of a BN nanotube: A Computational study [Volume 1, Issue 2, 2014, Pages 68-76]
  • Salari, Ali Akbar ADSORPTION OF PYRIDINE BY USING BeO NANOTUBE: A DFT STUDY [Volume 1, Issue 2, 2014, Pages 77-84]
  • Salari, Ali Akbar Hydroquinone detection by BN nanotube: DFT studies [Volume 1, Issue 3, 2014, Pages 115-125]
  • Salari, Ali Akbar Pyrrole detection by BeO nanotube: DFT studies [Volume 1, Issue 3, 2014, Pages 134-144]
  • Salehpour, Nabi Characterization and DFT studies of cis, trans and vinyl derivatives of 1,4-butadiene using C20 in different temperatures [Volume 5, Issue 2, 2018, Pages 487-492]
  • Salimian, Azita Comparison of doped combination zirconium-tungsten, zirconium- molybdenum and molybdenum-tungsten on single-wall vanadium oxide nanotube in hydrogen gas adsorption [Volume 4, Issue 3, 2017, Pages 100-110]
  • Salimian, Azita Study of Saturation and Supersaturation of Zr-Doped Vanadium Oxide Nanotubes [Volume 6, Issue 3, 2019, Pages 190-197]
  • Salmaniha, Mahnaz Investigation of Chemical Properties in Fullerene Derivatives of Fluoxetine Drug : A DFT Study [Volume 1, Issue 4, 2014, Pages 152-160]
  • Samadi, Susan Synthesis, Characterization, and Application of Zr,Ce-TiO2/SiO2 Nanocomposite Thin Film as Visible-light Active Photocatalyst [Volume 2, Issue 1, 2015, Pages 187-179]
  • Sargordan-Arani, Mohsen Nitration Ortho Dihydroxyl Benzene (Catechol) Using Bismuth Nitrate on the Solid Phase Montmorillonite [Volume 2, Issue 3, 2015, Pages 234-238]
  • Sarikhani, Zohreh Removal of toxic Cr(VI) ions from water sample a novel magnetic graphene oxide nanocomposite [(Articles in Press)]
  • Sarker, Md. Nuruzzaman The Prediction of Thermo Physical, Vibrational Spectroscopy, Chemical Reactivity, Biological Properties of Morpholinium Borate, Phosphate, Chloride and Bromide Ionic Liquid: A DFT Study [Volume 6, Issue 4, 2019, Pages 236-253]
  • Sarmad, Arash The study of the effect of changing the substituted on electron and orbital properties of the drug 2-(naftalin-1-ilmetil)-4,5-dihidro-1H-imidazol on nano structure fullerene using Hartree- fock method [Volume 3, Issue 3, 2016, Pages 88-96]
  • Sartipi, Maryam Ab Initio Studies: effect of various substituted on structural parameters and charge transfer energy of the Nafazolin drug and its nano carrier on fullerene [Volume 3, Issue 2, 2016, Pages 56-62]
  • Sayadi Anari, Mohammad Hussein Study on the Effect of Rainfall Level on the Size of Silver Nanoparticles Synthesized by Plants of the Lamiaceae Family in Different Regions of Iran [Volume 5, Issue 3, 2018, Pages 513-522]
  • Sedighi Gildeh, Masoumeh γ-Fe2O3@KSF: A recyclable catalyst for the efficient synthesis of pyrano-pyrimidinone derivatives [Volume 5, Issue 4, 2018, Pages 570-583]
  • Selvam, Guhanathan - Cytotoxic and anticancer studies of an oxygen and nitrogen donor novel Schiff base ligand and its copper (II) complex [Volume 6, Issue 1, 2019, Pages 1-13]
  • Selvam, Guhanathan Investigation of dibromo and N-bromoacetyl derivatives of [b] carbazole-synthesis and antibacterial evaluation [Volume 6, Issue 2, 2019, Pages 66-75]
  • Shahvelayati, Ashraf S. Microwave Assisted Synthesis of N-Benzylenaminones Catalyzed by Chloroacetic acid [Volume 1, Issue 4, 2014, Pages 145-151]
  • Shahzad, Hamideh Computational Study of the Mass, volume and Surface Effects on the Energetic Properties of RDX derivatives with Different Fullerenes (C20, C24 and C60) [Volume 5, Issue 1, 2018, Pages 419-426]
  • Shahzad, Hamideh QSAR relationships The changes in the ratio of electrons to the natural charge of atoms in the complexes of glycine and alanine amino acids with intermediates [Volume 4, Issue 2, 2017, Pages 36-47]
  • Shalagheh, Hashem The Lime and Flocculant Dose Optimization in the Clarification Process of a Sugar Factory [Volume 6, Issue 3, 2019, Pages 151-155]
  • Shalini, Jai PREPARATION AND CHARACTERIZATION OF TiO2 Fe2O3 NANOCOMPOSITE BY SOL GEL METHOD [Volume 5, Issue 4, 2018, Pages 593-599]
  • Shamsabadi, Leila Investigation of Fullerene effect on reactivity of 2-amino-3-(3,4-dihydroxyphenyl)-2-methyl-propanoic acid with NMR parameters [Volume 3, Issue 2, 2016, Pages 76-81]
  • Sharafie, Darioush Investigation of Nickle nanoclusters properties by density functional theory [Volume 5, Issue 4, 2018, Pages 600-609]
  • Shasti, Fathemeh Quantum chemistry studies on structures and electronic properties of the Tolazoline drug on nano structure of fullerene [Volume 3, Issue 2, 2016, Pages 63-69]
  • Sheikh, Behzad Study of Nitro Factor Dislodgement in Fox-7 [Volume 2, Issue 2, 2015, Pages 199-206]
  • Shemshaki, Leila The thermodynamic parameters derived material [1,5-b] tetrazolo [1,2,4] Terry inflorescences (TTA) with boron nitride nano- cages in different conditions of temperature , density functional theory method. [Volume 2, Issue 4, 2015, Pages 247-254]
  • Shirkhani, Ali Reza Separation, Preconcentration and determination of Hg (II) Ion in Water Samples by Cloud Point Extraction Technique Coupled with UV-VIS Spectrophotometry using a New Complexing Agent [Volume 6, Issue 3, 2019, Pages 163-177]
  • Smith, Sara Study of the Chemical Properties of RDX High-Energy Element and its Derivatives with Different Nanostructures of Mass by Functional Density Theory [Volume 4, Issue 3, 2017, Pages 117-125]
  • Subramaniyan, Alagappan PREPARATION AND CHARACTERIZATION OF TiO2 Fe2O3 NANOCOMPOSITE BY SOL GEL METHOD [Volume 5, Issue 4, 2018, Pages 593-599]

T

  • Tarvirdi zadeh, Reza A New Formula for Calculating the Viscosity of Base Oil and Polyisobutene Expensive Polymer for Lubricants [(Articles in Press)]
  • Tarvirdi-zadeh, Reza Synthesis of Liner Alkyl-benzene Sulfonate Nanoparticle Using Green Promoter and High Efficiency [Volume 6, Issue 2, 2019, Pages 76-86]
  • Tkach, Olduz Thermodynamic-Biochemical Study of Complexes of Intermediate Elements with α-Amino Acids in Some Proteins with Active Site [Volume 4, Issue 2, 2017, Pages 48-52]

U

  • Uroomiye, S. Sepehr Investigating the Effect of Fullerene on the Basicity of Paraphenylenediamine by using the Quantum Chemistry Methods [Volume 6, Issue 3, 2019, Pages 156-162]
  • Uthaikumar, Sangeetha Investigation of dibromo and N-bromoacetyl derivatives of [b] carbazole-synthesis and antibacterial evaluation [Volume 6, Issue 2, 2019, Pages 66-75]

V

  • Vesalian, Jila Microwave Assisted Synthesis of N-Benzylenaminones Catalyzed by Chloroacetic acid [Volume 1, Issue 4, 2014, Pages 145-151]

Y

  • Yousef, Mohamed A. K. Thermodynamic study of derivatives of PVC monomer with nanoparticles of fullerene, nanotube and nano cones at room temperature, using DFT method [Volume 4, Issue 3, 2017, Pages 134-141]

Z

  • Zargan, Mahmood Biofertilizer production from gas refinery wastewater [Volume 5, Issue 3, 2018, Pages 493-499]
  • Ziyaei Halimehjani, Azim Separation, Preconcentration and determination of Hg (II) Ion in Water Samples by Cloud Point Extraction Technique Coupled with UV-VIS Spectrophotometry using a New Complexing Agent [Volume 6, Issue 3, 2019, Pages 163-177]
  • Zolfaghari, Fereshteh Hydroquinone detection by BN nanotube: DFT studies [Volume 1, Issue 3, 2014, Pages 115-125]
  • Zolfaghari, Mahnaz Sadat A Thermodynamic Study on Nano-graphene Interaction with the Amino acid Phenylalanine in Acidic and Alkaline conditions at different temperatures [Volume 5, Issue 4, 2018, Pages 558-569]