| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio study of mechanism of forming a Si-heterocyclic spiro-Sn-heterocyclic ring compound by cycloaddition reaction of Me2Si=Sn: and ethene
|
Tan, Xiaojun
|
|
2019
|
|
2 |
p. 114-121
|
artikel
|
| 2 |
Ab initio study of the reaction between silylene germylidene (H2Si = Ge:) and ethene to form a bis-heterocyclic compound containing Si and Ge
|
Liu, Dongting
|
|
2013
|
|
2 |
p. 197-203
|
artikel
|
| 3 |
A Combined Quantum Mechanics and Molecular Mechanics Study on Nitrogen Oxide Adsorption/Dissociation on a Tungsten Oxide Surface
|
Izadyar, Mohammad
|
|
2015
|
|
2 |
p. 128-142
|
artikel
|
| 4 |
A computational study on the reaction mechanism of neutral phenol with formaldehyde in aqueous solution
|
Cao, Ming
|
|
2016
|
|
2 |
p. 144-152
|
artikel
|
| 5 |
A Density Functional Theory Study of Cyclization of Citronellal
|
Zardoost, Mohammad Reza
|
|
2012
|
|
2 |
p. 173-182
|
artikel
|
| 6 |
A density functional theory study of the oxygen reduction reaction on the (111) and (100) surfaces of cobalt(II) oxide
|
Qin, Bangchang
|
|
2019
|
|
2 |
p. 122-131
|
artikel
|
| 7 |
A DFT study of solvent effects on the kinetics and mechanism of the [3,3] hetero-Cope rearrangement of 1-butene thiobenzoate
|
Khavani, Mohammad
|
|
2016
|
|
2 |
p. 153-158
|
artikel
|
| 8 |
A DFT study on the effect of functional groups on the formation kinetics of 1,2,3-triazolo-1,4-benzoxazine via intramolecular 1,3-dipolar cycloaddition
|
Zardoost, Mohammad Reza
|
|
2013
|
|
2 |
p. 191-196
|
artikel
|
| 9 |
A DFT study on the kinetics and mechanism of cyclodiglycine thermal decomposition in the gas phase
|
Khavani, Mohammad
|
|
2016
|
|
2 |
p. 205-213
|
artikel
|
| 10 |
Adsorption of P-Nitrophenol Onto Partially Reduced Graphene Oxide: An Experimental and Theoretical Study
|
Yang, Mengzhi
|
|
2018
|
|
2 |
p. 189-200
|
artikel
|
| 11 |
Alkaline Fading of Triarylmethyl Carbocations in Self-Assembly Microheterogeneous Media
|
Astray, G.
|
|
2011
|
|
2 |
p. 139-165
|
artikel
|
| 12 |
A New Formulation for Quenching Processes under Restricted Geometry Conditions in the Slow Exchange Limit
|
Sanchez, F.
|
|
2014
|
|
2 |
p. 151-170
|
artikel
|
| 13 |
A new LHHW kinetic model for CO2 hydrogenation over an iron catalyst
|
Pour, Ali Nakhaei
|
|
2016
|
|
2 |
p. 159-169
|
artikel
|
| 14 |
A Theoretical Investigation of the Decomposition and Reactivity of the CHF2CF2CF2OCH2O• Radical from HFE-356pcc3 between 200 and 400 K
|
Hoseinpour, Sajedin
|
|
2017
|
|
2 |
p. 154-162
|
artikel
|
| 15 |
A Theoretical Study on the Functionalisation Process of C18NB Fullerene Through its Open [5,5] Cycloaddition with 4-Pyridine Nitrile Oxide
|
Siadati, Seyyed Amir
|
|
2015
|
|
2 |
p. 169-176
|
artikel
|
| 16 |
Atmospheric reactions of glyoxal with NO2 and NH2 radicals: Hydrogen abstraction mechanism and natural bond orbital analysis
|
Saghafi, Homeira
|
|
2019
|
|
2 |
p. 187-209
|
artikel
|
| 17 |
Behaviour Modelling of Organic Bases in the Oxyalkylation Reaction of Proton-Containing Nucleophiles
|
Bakhtin, Stanislav
|
|
2018
|
|
2 |
p. 121-135
|
artikel
|
| 18 |
Calculation of Arrhenius Parameters by the Rrkm Method for the Carbon–Hydrogen Bond Fission Reaction of Fluorobenzene
|
Manesh, Afshin Taghva
|
|
2017
|
|
2 |
p. 182-190
|
artikel
|
| 19 |
Can a Typical Protein Assist the Rate of its Own Aqueous Cleavage?
|
Khan, Mohammad Niyaz
|
|
2010
|
|
2 |
p. 131-165
|
artikel
|
| 20 |
Catalytic Performance of SAPO-34 Catalysts of Different Crystal Sizes in Methanol-to-Olefins Reactions: Effects of Synthetic Parameters
|
Askari, Sima
|
|
2015
|
|
2 |
p. 143-153
|
artikel
|
| 21 |
Chemical Reaction Dynamics at Liquid Interfaces: A Computational Approach
|
Benjamin, Ilan
|
|
2002
|
|
2 |
p. 87-126
|
artikel
|
| 22 |
Cleavage of Carbofuran and Carbofuran-Derivatives in Micellar Aggregates
|
Morales, J.
|
|
2015
|
|
2 |
p. 105-118
|
artikel
|
| 23 |
Computational Mechanistic Study of the Gas Phase Oxidation of Methanol with Ozone
|
Shayan, Kolsoom
|
|
2014
|
|
2 |
p. 171-185
|
artikel
|
| 24 |
[Cu-Ag2]O–C3N4 nanoframeworks for efficient photodegradation of wastewaters
|
Padervand, Mohsen
|
|
2019
|
|
2 |
p. 175-186
|
artikel
|
| 25 |
Cucurbit [7] Uril Host–Guest Complexation of Nereistoxin Investigated by Competitive Binding of Palmatine Fluorescent Probe
|
Zhang, Chen-Xuan
|
|
2015
|
|
2 |
p. 154-162
|
artikel
|
| 26 |
Cyclodextrin-Surfactant Mixed Systems as Reaction Media
|
Astray, G.
|
|
2010
|
|
2 |
p. 105-129
|
artikel
|
| 27 |
Density Functional Theoretical Study on the Mechanism of Adsorption of 2-Chlorophenol from Water Using γ-Fe2O3 Nanoparticles
|
Magham, A. Heshmati Jannat
|
|
2015
|
|
2 |
p. 119-127
|
artikel
|
| 28 |
Density Functional Theory Study on the Mechanism of Absorption of CO2 by the Ionic Liquid 1-Butyl-3-Methylimidazolium Acetate
|
Yan-Fe, Chen
|
|
2014
|
|
2 |
p. 197-208
|
artikel
|
| 29 |
Dft Study of Allylic Rearrangements (Cope Rearrangements) of Substituted Hexa-L,5-Dienes: Nbo and Nics Analysis
|
Aghaie, Hossein
|
|
2011
|
|
2 |
p. 166-177
|
artikel
|
| 30 |
DFT study on the regio- and stereo-selectivity of the Diels–Alder reaction between a cycloprop-2-ene carboxylate and some cyclic 1,3-dienes
|
Haghdadi, Mina
|
|
2016
|
|
2 |
p. 193-204
|
artikel
|
| 31 |
Diels–Alder Reactions of α-Cyano α,β-Unsaturated Ketones with 2-Methyl-1,3-Butadiene: DFT Study of Mechanism, Reactivity and Regioselectivity
|
Nouri, Azita
|
|
2015
|
|
2 |
p. 177-189
|
artikel
|
| 32 |
Effect of Temperature and Catalyst Type on the Catalytic Combustion of Formaldehyde
|
Ulukardesler, Ayse Hilal
|
|
2014
|
|
2 |
p. 186-196
|
artikel
|
| 33 |
Effects of Mixed Aqueous – Organic Cosolvents on the Rates of Cleavage of N-(2'-Hydroxyphenyl)Phthalimide (1) and N-(2'-Methoxyphenyl)-Phthalimide (2) in Alkaline Media
|
Abdullah, Norsalmi
|
|
2007
|
|
2 |
p. 51-71
|
artikel
|
| 34 |
Effects of Mixed H2O—CH3CN and H2O—HCONMe2 Solvents on the Rate of Cleavage of N-Benzylphthalamic Acid
|
Cheong, May-Ye
|
|
2008
|
|
2 |
p. 167-190
|
artikel
|
| 35 |
Effects of Some Operating Parameters on Sorption and Desorption Kinetics Related to Spotted Golden Thistle Stalks and Methylene Blue; Isotherm Study at Optimal pH and Sorbent Regeneration
|
Bereksi, Zoubida Senouci
|
|
2018
|
|
2 |
p. 173-188
|
artikel
|
| 36 |
Electrochemical Oxidation of Catechols in the Presence of Dimethyl Phosphite
|
Shoaei, Seyed Mohammad
|
|
2012
|
|
2 |
p. 138-146
|
artikel
|
| 37 |
Fabricating Nano-Sized BiVO4/InVO4/g-C3N4 Photocatalysts for Efficient Degradation of Acid Blue 92 Azo Dye
|
Tasviri, Mahboubeh
|
|
2018
|
|
2 |
p. 112-120
|
artikel
|
| 38 |
First-Principles Calculations on the Kinetics and Mechanism of the Retro-Ene Reaction of Diallyl Amine in the Gas Phase
|
Izadyar, Mohammad
|
|
2012
|
|
2 |
p. 193-202
|
artikel
|
| 39 |
Green and One-Pot Electrochemical Synthesis of New Benzofurans Based on an ECC Mechanism
|
Rajabi, Maryam
|
|
2015
|
|
2 |
p. 163-168
|
artikel
|
| 40 |
Horseradish Peroxidase Immobilization on Amine Functionalized Carbon Nano Tubes: Direct Electrochemistry and Bioelectrocatalysis
|
Tasviri, Mahboubeh
|
|
2012
|
|
2 |
p. 161-172
|
artikel
|
| 41 |
Hydroformylation of Dicyclopentadiene to Monoformyltricyclodecenes over Supported Ultra-Low Content Rh Catalysts
|
Li, Chengyang
|
|
2018
|
|
2 |
p. 166-172
|
artikel
|
| 42 |
Hydrolysis of bis(4-nitrophenyl) phosphate ester catalysed by a surfactant ligand cobalt(II) complex
|
Li, Shenxin
|
|
2016
|
|
2 |
p. 120-125
|
artikel
|
| 43 |
Inhibition of Atmospheric Aqueous Phase Autoxidation of Sulphur Dioxide by Volatile Organic Compounds: Mono-, di- and Tri-Substituted Benzenes and Benzoic Acids
|
Meena, Vimlesh Kumar
|
|
2017
|
|
2 |
p. 111-125
|
artikel
|
| 44 |
Investigation of Reaction Mechanisms and Kinetics of the Radical Scavenging Ability of 5-Tert-Butylbenzene-1,2,3-Triol and 3,5-di-Tert-Butylbenzene-1,2-Diol Compounds Towards OOH Radical
|
Saïd, Anes El-Hadj
|
|
2018
|
|
2 |
p. 101-111
|
artikel
|
| 45 |
Kinetic and Mechanistic Aspects of Ligand Substitution on cis- Diaqua (cis-1,2-Diaminocyclohexane)Platinum(II) with Three Glycine-Containing Dipeptides
|
Ray, Sumon
|
|
2014
|
|
2 |
p. 122-136
|
artikel
|
| 46 |
Kinetic and Mechanistic Patterns of Oxidation of Selenium(Iv)
|
Dikshitulu, L.S.A.
|
|
2009
|
|
2 |
p. 97-126
|
artikel
|
| 47 |
Kinetic and mechanistic study of drug–drug interaction between acetaminophen and β-lactam antibiotics
|
Nematollahi, Davood
|
|
2013
|
|
2 |
p. 213-219
|
artikel
|
| 48 |
Kinetic and Thermodynamic Studies of Uncatalysed and Hg(Ii)-Catalysed Solvolysis of a Chlorocobalt(Iii) Complex in Binary Aqueous Media
|
Fathalla, M.F.
|
|
2009
|
|
2 |
p. 183-197
|
artikel
|
| 49 |
Kinetic Isotope Effects as Probes for Hydrogen Tunneling, Coupled Motion and Dynamics Contributions to Enzyme Catalysis
|
Kohen, Amnon
|
|
2003
|
|
2 |
p. 119-156
|
artikel
|
| 50 |
Kinetics and Mechanism of Alkaline Hydrolysis of N-(o-Aminophenyl)Phthalimide in the Presence and Absence of Cationic Micelles and Sodium Salts of Aliphatic Acids
|
Ahmad, Wan Hamdah Wan
|
|
2018
|
|
2 |
p. 144-156
|
artikel
|
| 51 |
Kinetics and Mechanism of Degradation of Aqueous Promecarb Insecticide Studied by UV Spectrophotometry and HPLC
|
Bakhti, Hayet
|
|
2017
|
|
2 |
p. 145-153
|
artikel
|
| 52 |
Kinetics and Mechanism of the Kmn04-Oxidative Catalysed Condensation Reaction of L-Proline to a Diketopiperazine: Evidence for Delayed Autocatalytic Behaviour
|
Davari, Mehdi D.
|
|
2011
|
|
2 |
p. 95-119
|
artikel
|
| 53 |
Kinetics and Mechanism of the Oxidation of Substituted Benzaldehydes by [Bis(Trifluoroacetoxy)Iodo]Benzene
|
Purohit, Priyanka
|
|
2009
|
|
2 |
p. 141-154
|
artikel
|
| 54 |
Kinetics and Mechanism of the Permanganate-Induced Autocatalytic Dehydration Reaction of L-Y-Amino-N-Butyric Acid to Give 2-Pyrrolidone through a Radical Intermediate in Moderately Concentrated Acidic Medium
|
Bahrami, Homayoon
|
|
2011
|
|
2 |
p. 120-138
|
artikel
|
| 55 |
Kinetics of aquation of Ni(II) oxydiacetate complex induced by Fe(III) ions
|
Pranczk, Joanna
|
|
2016
|
|
2 |
p. 170-176
|
artikel
|
| 56 |
Kinetics of Dicyclopentadiene Hydroformylation over Rh–SiO2 Catalysts
|
Ma, Yubo
|
|
2017
|
|
2 |
p. 191-199
|
artikel
|
| 57 |
Kinetics of the Acetaminophen-Based Oscillatory Chemical Reaction with and without Ferroin as Catalyst: An Inorganic Prototype Model for Acetaminophen–Ethanol Syndrome
|
Riyaz, Sayima
|
|
2017
|
|
2 |
p. 163-181
|
artikel
|
| 58 |
Kinetic studies of manganese(III) and cobalt(II) Schiff base complexes as synthetic hydrolases for p-nitrophenyl picolinate in CTAB surfactant micellar solution
|
Zhang, Jin
|
|
2013
|
|
2 |
p. 143-156
|
artikel
|
| 59 |
Kinetic Studies of the Non-Isothermal Decomposition of Unirradiated and Γ-Irradiated Gallium Acetylacetonate
|
Al-Khamis, Kh.M.
|
|
2010
|
|
2 |
p. 187-207
|
artikel
|
| 60 |
Kinetic studies on the tert-butylation of toluene over H-BEA zeolite
|
Wang, Yuanyuan
|
|
2016
|
|
2 |
p. 126-134
|
artikel
|
| 61 |
Kinetic Study and Degradation Mechanism of Landrin in Aqueous Media
|
Ouertani, Randa
|
|
2012
|
|
2 |
p. 183-192
|
artikel
|
| 62 |
Kinetic study of the adsorption of dyes onto activated carbon
|
Eris, Setareh
|
|
2016
|
|
2 |
p. 109-119
|
artikel
|
| 63 |
Linear Solvation Energy Relationship (Lser) in the Allylation of 2-Mercapto-1-Methylimidazole
|
Vijayabharathi, Dharanipragada
|
|
2009
|
|
2 |
p. 155-163
|
artikel
|
| 64 |
Mechanism of Radiation Damage to Proteins and Dna – an Epr Perspective
|
Symons, Martyn C. R.
|
|
1999
|
|
2 |
p. 139-164
|
artikel
|
| 65 |
Mechanism of the Water-Catalysed Addition between Melamine and Formaldehyde: A Theoretical Investigation
|
Li, Taohong
|
|
2014
|
|
2 |
p. 103-114
|
artikel
|
| 66 |
Mechanisms of Horseradish Peroxidase and α-Chymotrypsin*
|
Dunford, H. Brian
|
|
2013
|
|
2 |
p. 119-129
|
artikel
|
| 67 |
Metallomicellar Catalysis: Hydrolysis of Pnpp by Crowned Schiff Base Cobalt(Ii) Complexes in Micellar Solution
|
Wei, Hu
|
|
2010
|
|
2 |
p. 167-186
|
artikel
|
| 68 |
Microelectrochemical Techniques for Probing Kinetics at Liquid/Liquid Interfaces
|
Guo, Si-Xuan
|
|
2004
|
|
2 |
p. 43-166
|
artikel
|
| 69 |
Modified Tafel Equation for Electroless Metal Deposition
|
Gorker, Lev
|
|
2009
|
|
2 |
p. 127-140
|
artikel
|
| 70 |
Nature of Salt Effects and Mechanism of Covalent Bond Heterolysis
|
Dvorko, Genrih F.
|
|
2007
|
|
2 |
p. 73-118
|
artikel
|
| 71 |
New Particle Size-Dependent Kinetic Model of the Water–Gas-Shift Reaction Using an Iron-Based Catalyst under Fischer – Tropsch Conditions
|
Pour, Ali Nakhaei
|
|
2014
|
|
2 |
p. 137-150
|
artikel
|
| 72 |
Non-Current-Field Induced Photocatalysis: Efficient Enhancement of Photooxidation of Organic Compounds with TiO2 Film Electrodes
|
Wang, Baohui
|
|
2013
|
|
2 |
p. 204-212
|
artikel
|
| 73 |
Oxidation reaction mechanism and kinetics between OH radicals and alkyl-substituted aliphatic thiols: OH-addition pathways
|
Tahan, Arezoo
|
|
2019
|
|
2 |
p. 157-174
|
artikel
|
| 74 |
1,10-Phenanthroline-Catalysed Cr(Vi) Oxidation of D-Sorbitol and D-Mannitol in Aqueous Micellar Media
|
Bayen, Ruhidas
|
|
2009
|
|
2 |
p. 165-181
|
artikel
|
| 75 |
Possible New Reaction Mechanisms of Dideoxynucleosides as Anti-Aids Drugs
|
Mamantov, Andrew
|
|
2008
|
|
2 |
p. 99-143
|
artikel
|
| 76 |
Proton transfer in the benzimidazolone and benzimidazolthione tautomerism process catalyzed by polar protic solvents
|
Abdeldjebar, Hasnia
|
|
2019
|
|
2 |
p. 143-156
|
artikel
|
| 77 |
Pt/Al2O3 Catalyst Prepared from Water-in-Oil Microemulsion and Used in Catalytic Hydrogenation
|
Li, Feng
|
|
2015
|
|
2 |
p. 190-200
|
artikel
|
| 78 |
Pyrolysis and gasification of macroalgae Enteromorpha prolifera under a CO2 atmosphere using the thermogravimetry–Fourier transform infrared spectroscopy technique
|
Cao, Junrui
|
|
2019
|
|
2 |
p. 132-142
|
artikel
|
| 79 |
Pyrolysis Kinetics and Emission Characteristics of Waste Disposable Paper Cups Using the Thermogravimetric-FTIR Technique
|
Song, Daiwang
|
|
2017
|
|
2 |
p. 126-135
|
artikel
|
| 80 |
Quantifying Enhancement of Metal-Supported Zeolites Due to Hydrogen Spillover
|
Pai, Shrivanand M.
|
|
2018
|
|
2 |
p. 157-165
|
artikel
|
| 81 |
Radiation Effects on Zeolite Nanomaterials - Some Potential Implications for Cleaning Liquid Nuclear Waste and for Enhanced Radioactive Decontamination
|
Rhodes, Christopher J.
|
|
2012
|
|
2 |
p. 103-137
|
artikel
|
| 82 |
Recent Developments in Dispersive Kinetics
|
Plonka, Andrzej
|
|
2000
|
|
2 |
p. 109-217
|
artikel
|
| 83 |
Single electron transfer in SNAr process: Reactions of 2,4,6-tris(trifluoromethanesulfonyl)anisole with anilines in dimethyl sulfoxide
|
Guesmi, N. El
|
|
2013
|
|
2 |
p. 130-142
|
artikel
|
| 84 |
SiO2-Supported Co–Rh Bimetallic Catalysts for Dicyclopentadiene Hydroformylation: Relationships Between Catalytic Performance and Structure of the Catalysts
|
Zhang, Libo
|
|
2018
|
|
2 |
p. 136-143
|
artikel
|
| 85 |
Solvent Parameters Effects on the Second-Order Rate Constants of the Reaction of 2-Chloro-3,5-Dinitropyridine with Aniline in Aqueous Solutions of Alcohols
|
Harifi-Mood, Ali Reza
|
|
2006
|
|
2 |
p. 117-127
|
artikel
|
| 86 |
Specific Solvation Effects on the Formation of Urea Anion in Alkaline Solution
|
Li, Taohong
|
|
2014
|
|
2 |
p. 115-121
|
artikel
|
| 87 |
Spectroscopy and Dynamics of the Laser Induced Intracluster (Ba··FCH3)* → BaF* + CH3 AND Ba* + Fch3 Reaction
|
Skowronek, S.
|
|
1999
|
|
2 |
p. 101-137
|
artikel
|
| 88 |
Studies on Characterisation of Kinetically Active Cerium(IV) Species in Oxidation of α-Hydroxy Acids in Aqueous Micellar Sulfuric Acid Media
|
Das, Asim K.
|
|
2008
|
|
2 |
p. 145-165
|
artikel
|
| 89 |
Study on the reactions between dichlorido[2,2′:6′,2″-terpyridine] zinc(II) and biologically relevant nucleophiles in aqueous solution
|
Selimović, Enisa
|
|
2019
|
|
2 |
p. 105-113
|
artikel
|
| 90 |
Surface Decomposition of Dimethyl Methylphosphonate on SnO2 Nanoparticles: Role of Nanoparticle Size
|
Zamand, Nasser
|
|
2017
|
|
2 |
p. 99-110
|
artikel
|
| 91 |
Systems Designed with an Ionic Liquid and Molecular Solvents to Investigate the Kinetics of an SNAr Reaction
|
Salari, Hadi
|
|
2013
|
|
2 |
p. 157-170
|
artikel
|
| 92 |
Template Effect in the Self-Assembly of a [2]Rotaxane Containing Diazapyrenium Units
|
Bruschini, Michele
|
|
2010
|
|
2 |
p. 209-217
|
artikel
|
| 93 |
The Allylic Rearrangements (Claisen and Thio-Claisen) and Decomposition Reactions of Allyl Formate and its Sulfur Analogue: Density Function Theory Study and Nucleus-Independent Chemical Shifts
|
Shiroudi, Abolfazl
|
|
2013
|
|
2 |
p. 171-182
|
artikel
|
| 94 |
Theoretical investigation of the mechanism of forming a silicic bis-heterocyclic compound between dichlorosilylenesilylene [Cl2Si = Si:] and ethylene
|
Sun, Xiangting
|
|
2013
|
|
2 |
p. 183-190
|
artikel
|
| 95 |
Theoretical Study of Solvent and Substituent Effects on the Reactions of 1,4-Benzoquinone with Cyclopentadiene and Cyclohexadiene
|
Haqghu, Mohammad
|
|
2008
|
|
2 |
p. 191-206
|
artikel
|
| 96 |
Theoretical study on the reaction mechanisms of CH3ONO with F, Cl and Br atoms
|
Wang, Lu
|
|
2016
|
|
2 |
p. 135-143
|
artikel
|
| 97 |
The Palladium(Ii)-Catalysed Ligand Exchange between Hexacyanoferrate(Ii) and 4-Cyanopyridine in Aqueous Acidic Medium
|
Naik, Radhey Mohan
|
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2012
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