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Afshin Taghva Manesh
Afshin Taghva Manesh
Professor of Physical Chemistry
在 iauctb.ac.ir 的电子邮件经过验证 - 首页
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引用次数
引用次数
年份
Ab Initio Calculations of the Conformational Preferences of 1,3-Oxathiane S-Oxide and its Analogs Containing S and SE Atoms—Evidence for Stereoelectronic …
N Masnabadi, AT Manesh, F Azarakhshi
Phosphorus, Sulfur, and Silicon and the Related Elements 188 (8), 1053-1063, 2013
92013
Process Optimization and Kinetic study of Wet Peroxide Oxidation of Phenol in Wastewater over Mg-Al Nano Mixed Oxide
M Samandari, A Taghva Manesh, SA Hosseini, S Mansouri
Iranian Journal of Catalysis 11 (2), 175-180, 2021
52021
The new type of heteroborospherene as a potential promising high drug-loading capacity for carmustine anticancer drug: Theoretical perspectives
H Soleymanabadi, M Karimkhani, AT Manesh
Computational and Theoretical Chemistry 1238, 114741, 2024
22024
A detailed kinetic study on the tautomerization reactions of barbituric acid: A combined DFT-QTAIM analysis
N Hajali, A Taghva Manesh, A Seif
Main Group Chemistry 21 (2), 681-696, 2022
22022
Homo pair formations of thiobarbituric acid: DFT calculations and QTAIM analysis
L Fatahiyan, A Taghva Manesh, N Masan Abadi
Main Group Chemistry 21 (1), 303-313, 2022
22022
Variational RRKM theory calculation of thermal rate constant for carbon—hydrogen bond fission reaction of nitro benzene
AT Manesh, Z Heidarnezhad, N Masnabadi
Russian Journal of Physical Chemistry A 87, 1175-1179, 2013
22013
Tautomerization reactions of thiobarbituric acid: A detailed kinetic study using combined canonical variational transition state theory and QTAIM approach
L Fatahiyan, A Taghva Manesh, N Masnabadi
International Journal of Chemical Kinetics 55 (5), 247-260, 2023
12023
Investigating Functionalization Impacts on Structural Features of Barbituric Acid Derivatives: DFT Approach
N Hajali, A Taghva Manesh, A Seif
Main Group Chemistry 20 (4), 529-537, 2021
12021
Lithium Including Mixed Sodium Inside Graphene Oxide (GO) as Anodic Electrodes for ion Batteries.
S Bagheri, M Monajjemi, A Ziglari, AT Manesh
Oriental Journal of Chemistry 34 (2), 2018
12018
Development of electronic nanosensor using B36 borophene nanosheets to detect phosgene: A molecular quantum mechanics approach
H Soleymanabadi, M Karimkhani, AT Manesh
Computational and Theoretical Chemistry, 114843, 2024
2024
Tautomerization reactions of thiobarbituric acid: A detailed kinetic study using combined TST and QTAIM approach
L Fatahiyan, AT Manesh, N Masnabadi
Authorea Preprints, 2022
2022
Synthesis and Characterization of Photo‐catalyst Ag2S/WO3 and its Application for Crystal Violet Degradation in the Aqueous Medium
M Abdoli, AT Manesh, M Ghaedi, M Aghaie
ChemistrySelect 7 (9), e202103439, 2022
2022
Formations of bimolecular barbituric acid complexes through hydrogen bonding interactions: DFT analyses of structural and electronic features
N Hajali, A Taghva Manesh, A Seif
Main Group Chemistry 21 (1), 145-155, 2022
2022
Calculation of Arrhenius parameters by the RRKM method for the carbon–hydrogen bond fission reaction of fluorobenzene
AT Manesh, Z Heidarnezhad, M Vahedpour, N Masnabadi
Progress in Reaction Kinetics and Mechanism 42 (2), 182-190, 2017
2017
Variational RRKM calculation of thermal rate constant for C–H bond fission reaction of nitro methane
AT Manesh, R Solhnejad
Arabian Journal of Chemistry 10, S1055-S1058, 2017
2017
Conformational Behaviors of 2, 6-Dihalothiane-1-oxides and their Containing Se atom Analogous; encounter between Stereoelectronic and Steric Effects
N Masnabadi, AT Manesh
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