Comparison of performance of van der Waals-corrected exchange-correlation functionals for interlayer interaction in graphene and hexagonal boron nitride
Lebedeva, Irina V., Lebedev, Alexander V., Popov, Andrey M., Knizhnik, Andrey A.
Published in Computational materials science (15.02.2017)
Published in Computational materials science (15.02.2017)
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Journal Article
Formation of the icosahedral C 60 fullerene via migration of single sp atoms and annihilation of sp-atom pairs
Sinitsa, Alexander S, Polynskaya, Yulia G, Matsokin, Nikita A, Kedalo, Yegor M, Knizhnik, Andrey A, Popov, Andrey M
Published in Physical chemistry chemical physics : PCCP (14.08.2024)
Published in Physical chemistry chemical physics : PCCP (14.08.2024)
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Journal Article
Formation of the icosahedral C60 fullerene via migration of single sp atoms and annihilation of sp-atom pairs
Sinitsa, Alexander S, Polynskaya, Yulia G, Matsokin, Nikita A, Kedalo, Yegor M, Knizhnik, Andrey A, Popov, Andrey M
Published in Physical chemistry chemical physics : PCCP (14.08.2024)
Published in Physical chemistry chemical physics : PCCP (14.08.2024)
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Journal Article
Interlayer interaction and relative vibrations of bilayer graphene
Lebedeva, Irina V, Knizhnik, Andrey A, Popov, Andrey M, Lozovik, Yurii E, Potapkin, Boris V
Published in Physical chemistry chemical physics : PCCP (01.01.2011)
Published in Physical chemistry chemical physics : PCCP (01.01.2011)
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Journal Article
Formation of carbon propeller-like molecules from starphenes under electron irradiation
Matsokin, Nikita A, Sinitsa, Alexander S, Polynskaya, Yulia G, Lebedeva, Irina V, Knizhnik, Andrey A, Popov, Andrey M
Published in Physical chemistry chemical physics : PCCP (18.10.2023)
Published in Physical chemistry chemical physics : PCCP (18.10.2023)
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Journal Article
Molecular Dynamics Study of Ternary Montmorillonite–MT2EtOH–Polyamide‑6 Nanocomposite: Structural, Dynamical, and Mechanical Properties of the Interfacial Region
Skomorokhov, Anton S, Knizhnik, Andrey A, Potapkin, Boris V
Published in The journal of physical chemistry. B (28.03.2019)
Published in The journal of physical chemistry. B (28.03.2019)
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Journal Article
Interlayer interaction and related properties of bilayer hexagonal boron nitride: ab initio study
Lebedev, Alexander V, Lebedeva, Irina V, Knizhnik, Andrey A, Popov, Andrey M
Published in RSC advances (01.01.2016)
Published in RSC advances (01.01.2016)
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Journal Article
Transformation of Amorphous Carbon Clusters to Fullerenes
Sinitsa, Alexander S, Lebedeva, Irina V, Popov, Andrey M, Knizhnik, Andrey A
Published in Journal of physical chemistry. C (22.06.2017)
Published in Journal of physical chemistry. C (22.06.2017)
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Journal Article
Molecular Dynamics Study of sp-Defect Migration in Odd Fullerene: Possible Role in Synthesis of Abundant Isomers of Fullerenes
Sinitsa, Alexander S, Lebedeva, Irina V, Polynskaya, Yulia G, Popov, Andrey M, Knizhnik, Andrey A
Published in Journal of physical chemistry. C (28.05.2020)
Published in Journal of physical chemistry. C (28.05.2020)
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Journal Article
Corrigendum to “Long triple carbon chains formation by heat treatment of graphene nanoribbon: Molecular dynamics study with revised Brenner potential” [Carbon 140 (2018) 543–556]
Sinitsa, Alexander S., Lebedeva, Irina V., Popov, Andrey M., Knizhnik, Andrey A.
Published in Carbon (New York) (01.05.2019)
Published in Carbon (New York) (01.05.2019)
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Journal Article
Formation of Nickel Clusters Wrapped in Carbon Cages: Toward New Endohedral Metallofullerene Synthesis
Sinitsa, Alexander S, Chamberlain, Thomas W, Zoberbier, Thilo, Lebedeva, Irina V, Popov, Andrey M, Knizhnik, Andrey A, McSweeney, Robert L, Biskupek, Johannes, Kaiser, Ute, Khlobystov, Andrei N
Published in Nano letters (08.02.2017)
Published in Nano letters (08.02.2017)
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Journal Article
A Theoretical Study on the Mechanism of Small Carbon Clusters Growth in Low-Temperature Plasma
Polynskaya, Yulia G., Matsokin, Nikita A., Kedalo, Yegor M., Knizhnik, Andrey A., Sinitsa, Alex S., Potapkin, Boris V.
Published in Plasma chemistry and plasma processing (2024)
Published in Plasma chemistry and plasma processing (2024)
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Journal Article
Analysis of structural organization and interaction mechanisms of detonation nanodiamond particles in hydrosols
Knizhnik, Andrey A, Polynskaya, Yulia G, Sinitsa, Alexander S, Kuznetsov, Nikita M, Belousov, Sergey I, Chvalun, Sergei N, Potapkin, Boris V
Published in Physical chemistry chemical physics : PCCP (06.01.2021)
Published in Physical chemistry chemical physics : PCCP (06.01.2021)
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Journal Article
Transformation of a graphene nanoribbon into a hybrid 1D nanoobject with alternating double chains and polycyclic regions
Sinitsa, Alexander S, Lebedeva, Irina V, Polynskaya, Yulia G, de Oteyza, Dimas G, Ratkevich, Sergey V, Knizhnik, Andrey A, Popov, Andrey M, Poklonski, Nikolai A, Lozovik, Yurii E
Published in Physical chemistry chemical physics : PCCP (06.01.2021)
Published in Physical chemistry chemical physics : PCCP (06.01.2021)
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Journal Article
Diffusion and drift of graphene flake on graphite surface
Lebedeva, Irina V, Knizhnik, Andrey A, Popov, Andrey M, Ershova, Olga V, Lozovik, Yurii E, Potapkin, Boris V
Published in The Journal of chemical physics (14.03.2011)
Published in The Journal of chemical physics (14.03.2011)
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