Lvova, N.A., Ananina, O.Yu., Ryazanova, A.I. (2016) Fluorine and carbon fluoride interaction with a diamond surface: Quantum-chemical modeling. Computational Materials Science, 124. 30-36 doi:10.1016/j.commatsci.2016.07.014

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Reference Type	Journal (article/letter/editorial)
Title	Fluorine and carbon fluoride interaction with a diamond surface: Quantum-chemical modeling
Journal	Computational Materials Science
Authors	Lvova, N.A.		Author
	Ananina, O.Yu.		Author
	Ryazanova, A.I.		Author
Year	2016 (November)	Volume	124
Publisher	Elsevier BV
DOI	doi:10.1016/j.commatsci.2016.07.014Search in ResearchGate
	Generate Citation Formats
Mindat Ref. ID	9509929	Long-form Identifier	mindat:1:5:9509929:9
GUID	0
Full Reference	Lvova, N.A., Ananina, O.Yu., Ryazanova, A.I. (2016) Fluorine and carbon fluoride interaction with a diamond surface: Quantum-chemical modeling. Computational Materials Science, 124. 30-36 doi:10.1016/j.commatsci.2016.07.014
Plain Text	Lvova, N.A., Ananina, O.Yu., Ryazanova, A.I. (2016) Fluorine and carbon fluoride interaction with a diamond surface: Quantum-chemical modeling. Computational Materials Science, 124. 30-36 doi:10.1016/j.commatsci.2016.07.014
In	(n.d.) Computational Materials Science Vol. 124. Elsevier BV

	*Lvova, N.A., Ananina, O.Yu. (2016) Theoretical study of the adsorption properties of porous boron nitride nanosheets. Computational Materials Science, 115. 11-17 doi:10.1016/j.commatsci.2015.12.035*
	*Lvova, N.A., Ponomarev, O.V., Ryazanova, A.I. (2017) Vacancies in the C(1 0 0)-(2 × 1) diamond surface layers. Computational Materials Science, 131. 301-307 doi:10.1016/j.commatsci.2017.02.009*
	Lvova, N.A., Ananina, O.Yu. (2015) Theoretical study of graphene functionalization by F− and FHF− ions from associates with water molecules. Computational Materials Science, 101. 287-292 doi:10.1016/j.commatsci.2015.02.007
	*Ponomarev, O.V., Ryazanova, A.I., Lvova, N.A. (2018) Nitrogen-vacancy defects near the С(100)-(2 × 1) diamond surface. Surface Science, 667. 92-100 doi:10.1016/j.susc.2017.10.003*
	Lvova, N. A., Ponomarev, O. V., Ananina, O. Yu., Ryazanova, A. I. (2017) Boron atoms in the subsurface layers of diamond: Quantum chemical modeling. Russian Journal of Physical Chemistry A, 91 (8). 1451-1456 doi:10.1134/s0036024417080180
	Lvova, N. A., Ananina, O. Yu. (2013) Quantum chemical simulations of water adsorption on a diamond (100) surface with vacancy defects. Russian Journal of Physical Chemistry A, 87 (9). 1515-1519 doi:10.1134/s0036024413090148
	Yanovsky, Olexandr, Ananina, Olga, Butrimov, Pavel (2012) Quantum-chemical simulation of graphite nanoclusters stability. Computational Materials Science, 58. 214-217 doi:10.1016/j.commatsci.2012.01.039
	Ryazanova, A. I., Lvova, N. A. (2019) Adsorption Properties of the C(100)-(2×1) Diamond Surface with Vacancy Defects and “Nitrogen + Vacancy” Complexes. Russian Journal of Physical Chemistry A, 93 (4). 751-757 doi:10.1134/s003602441904023x
	Digurova, A. I., Lvova, N. A. (2022) Effect of Vacancy Defects and Oxygen on the Interaction between Water and a Diamond Surface: Quantum Chemistry Modeling. Russian Journal of Physical Chemistry A, 96 (5) 1015-1021 doi:10.1134/s0036024422050089
	Zavodinsky, V.G., Mikhailenko, E.A. (2006) Quantum-mechanics simulation of carbon nanoclusters and their activities in reactions with molecular oxygen. Computational Materials Science, 36 (1). 159-165 doi:10.1016/j.commatsci.2004.12.079
	*Ishikawa, Takahiro (2014) Potential energy surface trekking: Application to carbon at terapascal pressures. Computational Materials Science, 92. 36-40 doi:10.1016/j.commatsci.2014.05.024*

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Lvova, N.A., Ananina, O.Yu., Ryazanova, A.I. (2016) Fluorine and carbon fluoride interaction with a diamond surface: Quantum-chemical modeling. Computational Materials Science, 124. 30-36 doi:10.1016/j.commatsci.2016.07.014

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