Name Safa Heydari Affiliation دانشجوی دانشگاه مراغه Degree _ Website Email — JournalPaper Presentation FinishedProject Book Thesis Speech Innovation ResearchExcellence Sabbatical TheorizingChair GrantAttraction WorkShop Membership JournalPublication ExecutiveActivity TitleJournal 1 Li, Na and K Storage Capacity of a Novel 2D Graphitic Carbon-Nitride Membrane, C9N4:A Computational Approach Chemical Physics Letters 2 Si-doped C3N monolayers as efficient single-atom catalysts for reduction of N2O: a computational study MOLECULAR PHYSICS 3 NO reduction over Al-embedded MoS2 monolayer: A first-principles study RSC Advances 4 A comparative DFT study about surface reactivity and catalytic activity of Pd- and Ni-doped BN nanosheets: NO reduction by CO molecule Structural Chemistry 5 A promising and new single-atom catalyst for CO oxidation: Si-embedded MoS2 monolayer JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS 6 An effective approach for tuning catalytic activity of C3N nanosheets: chemical-doping with the Si atom JOURNAL OF MOLECULAR GRAPHICS & MODELLING 7 C59N Heterofullerene: A Promising Catalyst for NO Conversion into N2O CHEMISTRYSELECT 8 B-doped C3N monolayer: A robust catalyst for oxidation of carbon monoxide THEORETICAL CHEMISTRY ACCOUNTS 9 Catalytic reduction of nitrous oxide over boron-doped C3N monolayers: A DFT study Chemical Physics Letters 10 A DFT study on NO reduction to N2O using Al- and P-doped hexagonal boron nitride nanosheets JOURNAL OF MOLECULAR GRAPHICS & MODELLING 11 C59X Heterofullerenes (X = N, B, Si, P and S) as Catalysts for Reduction of N2O: A Comparative DFT Study CHEMISTRYSELECT 12 CO catalytic oxidation over C59X heterofullerenes (X=B, Si, P, S): A DFT study Computational and Theoretical Chemistry 13 CO Oxidation Catalyzed by a Single Ti Atom Supported on Divacancy Defective Graphene: A Dispersion-Corrected DFT Study CHEMISTRYSELECT 14 Carbon-doped boronnitride fullerenes asefficient metal-freecatalysts for oxidation of SO2: A DFT study Structural Chemistry