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Bondarchuk, Sergey V., Minaev, Boris F. (2011) Density functional study of ortho-substituted phenyl cations in polar medium and in the gas phase. Chemical Physics, 389. 68-74 doi:10.1016/j.chemphys.2011.08.005

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Reference TypeJournal (article/letter/editorial)
TitleDensity functional study of ortho-substituted phenyl cations in polar medium and in the gas phase
JournalChemical Physics
AuthorsBondarchuk, Sergey V.Author
Minaev, Boris F.Author
Year2011 (November)Volume389
PublisherElsevier BV
DOIdoi:10.1016/j.chemphys.2011.08.005Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID5962714Long-form Identifiermindat:1:5:5962714:6
GUID0
Full ReferenceBondarchuk, Sergey V., Minaev, Boris F. (2011) Density functional study of ortho-substituted phenyl cations in polar medium and in the gas phase. Chemical Physics, 389. 68-74 doi:10.1016/j.chemphys.2011.08.005
Plain TextBondarchuk, Sergey V., Minaev, Boris F. (2011) Density functional study of ortho-substituted phenyl cations in polar medium and in the gas phase. Chemical Physics, 389. 68-74 doi:10.1016/j.chemphys.2011.08.005
In(n.d.) Chemical Physics Vol. 389. Elsevier BV

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Minaev, Boris F., Bondarchuk, Sergey V., Gîrţu, Mihai A. (2009) DFT study of electronic properties, structure and spectra of aryl diazonium cations. Journal of Molecular Structure: THEOCHEM, 904. 14-20 doi:10.1016/j.theochem.2009.02.022
Bondarchuk, Sergey V., Minaev, Boris F. (2014) State-Dependent Global and Local Electrophilicity of the Aryl Cations. The Journal of Physical Chemistry A, 118 (17). 3201-3210 doi:10.1021/jp501740p
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Bondarchuk, Sergey V., Minaev, Boris F. (2017) DFT design of polyguanidine – a unique two-dimensional material with high-energy density. Molecular Physics, 115. 2423-2430 doi:10.1080/00268976.2017.1321157
Bondarchuk, Sergey V., Smalius, Victor V., Minaev, Boris F. (2015) A combined experimental and density functional study of 1-(arylsulfonyl)-2-R-4-chloro-2-butenes reactivity towards the allylic chlorine. Journal of Physical Organic Chemistry, 28 (6). 403-413 doi:10.1002/poc.3425
Bondarchuk, Sergey V., Minaev, Boris F. (2017) Super high-energy density single-bonded trigonal nitrogen allotrope—a chemical twin of the cubic gauche form of nitrogen. Physical Chemistry Chemical Physics, 19 (9). 6698-6706 doi:10.1039/c6cp08723j
Bondarchuk, Sergey V., Minaev, Boris F. (2014) The singlet–triplet energy splitting of π-nucleophiles as a measure of their reaction rate with electrophilic partners. Chemical Physics Letters, 607. 75-80 doi:10.1016/j.cplett.2014.05.040
Bondarchuk, Sergey V., Minaev, Boris F. (2010) About possibility of the triplet mechanism of the Meerwein reaction. Journal of Molecular Structure: THEOCHEM, 952. 1-7 doi:10.1016/j.theochem.2010.04.025
Chandra Jha, Prakash, Minaev, Boris, Ã…gren, Hans (2008) One- and two-photon Absorptions in asymmetrically substituted free-base porphyrins: A density functional theory study. The Journal of Chemical Physics, 128 (7). 74302pp. doi:10.1063/1.2838776
Bondarchuk, Sergey V., Minaev, Boris F. (2017) Two-dimensional honeycomb (A7) and zigzag sheet (ZS) type nitrogen monolayers. A first principles study of structural, electronic, spectral, and mechanical properties. Computational Materials Science, 133. 122-129 doi:10.1016/j.commatsci.2017.03.007
Bondarchuk, Sergey V., Minaev, Boris F. (2014) Theoretical Study of Relationships between Structural, Optical, Energetic, and Magnetic Properties and Reactivity Parameters of Benzidine and Its Oxidized Forms. The Journal of Physical Chemistry A, 118 (38). 8872-8882 doi:10.1021/jp507479p
 
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