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Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy|July 19, 2011
One-pot synthesis, FT-IR, NMR and density functional method (B3LYP) studies on 2-(cyclohexylamino)-2-oxo-1-(pyridin-2-yl)ethyl benzoateE Fereyduni, E Vessally, E Yaaghubi, et al.Journal of Molecular Graphics & Modelling|March 22, 2017
Na-ion batteries based on the inorganic BN nanocluster anodes: DFT studiesK Nejati, A Hosseinian, A Bekhradnia, et al.Journal of Molecular Modeling|March 31, 2017
Selective detection of cyanogen halides by BN nanocluster: a DFT studyE Vessally, F Behmagham, B Massuomi, et al.Journal of Molecular Graphics & Modelling|December 13, 2017
On lithium doping in two stable nano-flakes of the B24: The double-ring versus the quasiplanar configurationA Hosseinian, E Vessally, M Babazadeh, et al.Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy|February 7, 2015
Experimental and theoretical study on diethyl-(Z)-2-(5,7-diphenyl-1,3,4-oxadiazepin-2-yl)-2-butenedioate using different levels of computational methodsZ Asadi, M B Asnaashariisfahani, E Vessally, et al.Journal of Molecular Modeling|November 28, 2017
A DFT study on graphene, SiC, BN, and AlN nanosheets as anodes in Na-ion batteriesA Hosseinian, E Saedi Khosroshahi, K Nejati, et al.Journal of Molecular Graphics & Modelling|March 2, 2017
A DFT study on the central-ring doped HBC nanographenesA Hosseinian, A Bekhradnia, E Vessally, et al.Beilstein Journal of Organic Chemistry|May 11, 2017
N-Propargylamines: versatile building blocks in the construction of thiazole coresS Arshadi, E Vessally, L Edjlali, et al.Pageof 1