Nano-ionics in the context of lithium batteries
Balaya, P., Bhattacharyya, A.J., Jamnik, J., Zhukovskii, Yu.F., Kotomin, E.A., Maier, J.
Published in Journal of power sources (01.09.2006)
Published in Journal of power sources (01.09.2006)
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Journal Article
Symmetry and Models of Single-Wall BN and TiO2 Nanotubes with Hexagonal Morphology
Evarestov, R. A, Zhukovskii, Yu. F, Bandura, A. V, Piskunov, S
Published in Journal of physical chemistry. C (16.12.2010)
Published in Journal of physical chemistry. C (16.12.2010)
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Journal Article
Ab initio modeling of oxygen impurity atom incorporation into uranium mononitride surface and sub-surface vacancies
Bocharov, D., Gryaznov, D., Zhukovskii, Yu.F., Kotomin, E.A.
Published in Journal of nuclear materials (01.09.2011)
Published in Journal of nuclear materials (01.09.2011)
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Journal Article
Conference Proceeding
Symmetry and Models of Double-Wall BN and TiO2 Nanotubes with Hexagonal Morphology
Evarestov, R. A, Zhukovskii, Yu. F, Bandura, A. V, Piskunov, S, Losev, M. V
Published in Journal of physical chemistry. C (28.07.2011)
Published in Journal of physical chemistry. C (28.07.2011)
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Journal Article
A comparative ab initio study of bulk and surface oxygen vacancies in PbTiO3, PbZrO3 and SrTiO3 perovskites
ZHUKOVSKII, Yu. F, KOTOMIN, E. A, PISKUNOV, S, ELLIS, D. E
Published in Solid state communications (01.09.2009)
Published in Solid state communications (01.09.2009)
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Journal Article
Structural and electronic properties of single-walled AlN nanotubes of different chiralities and sizes
Zhukovskii, Yu F, Popov, A I, Balasubramanian, C, Bellucci, S
Published in Journal of physics. Condensed matter (23.08.2006)
Published in Journal of physics. Condensed matter (23.08.2006)
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Journal Article
Conference Proceeding
DFT calculations of point defects on UN(001) surface
Bocharov, D., Gryaznov, D., Zhukovskii, Yu.F., Kotomin, E.A.
Published in Surface science (01.02.2011)
Published in Surface science (01.02.2011)
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Journal Article
Chemisorption of a molecular oxygen on the UN(0 0 1) surface: Ab initio calculations
Zhukovskii, Yu.F., Bocharov, D., Kotomin, E.A.
Published in Journal of nuclear materials (15.09.2009)
Published in Journal of nuclear materials (15.09.2009)
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Journal Article
Influence of F centres on structural and electronic properties of AlN single-walled nanotubes
Zhukovskii, Yu F, Pugno, N, Popov, A I, Balasubramanian, C, Bellucci, S
Published in Journal of physics. Condensed matter (03.10.2007)
Published in Journal of physics. Condensed matter (03.10.2007)
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Journal Article
Conference Proceeding
first-principles DFT study of UN bulk and (001) surface: Comparative LCAO and PW calculations
Evarestov, R.A, Bandura, A.V, Losev, M.V, Kotomin, E.A, Zhukovskii, Yu.F, Bocharov, D
Published in Journal of computational chemistry (01.10.2008)
Published in Journal of computational chemistry (01.10.2008)
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Journal Article
The electronic properties of an oxygen vacancy at ZrO2-terminated (001) surfaces of a cubic PbZrO3 : computer simulations from the first principles
KOTOMIN, E. A, PISKUNOV, S, ZHUKOVSKII, Yu. F, EGLITIS, R. I, GOPEJENKO, A, ELLIS, D. E
Published in Physical chemistry chemical physics : PCCP (01.01.2008)
Published in Physical chemistry chemical physics : PCCP (01.01.2008)
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Journal Article
First principles calculations of oxygen adsorption on the UN(001) surface
Zhukovskii, Yu.F., Bocharov, D., Kotomin, E.A., Evarestov, R.A., Bandura, A.V.
Published in Surface science (01.01.2009)
Published in Surface science (01.01.2009)
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Journal Article
DFT study of a single F center in cubic SrTiO3 perovskite
Evarestov, R. A., Kotomin, E. A., Zhukovskii, Yu. F.
Published in International journal of quantum chemistry (15.08.2006)
Published in International journal of quantum chemistry (15.08.2006)
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Journal Article
A comparative analysis of electron spectroscopy and first-principles studies on Cu(Pd) adsorption on MgO
Krischok, S., Stracke, P., Höfft, O., Kempter, V., Zhukovskii, Yu.F., Kotomin, E.A.
Published in Surface science (15.09.2006)
Published in Surface science (15.09.2006)
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Journal Article
Conference Proceeding