Научные работы пользователей ЦКП вычислительными ресурсами МСЦ РАН, опубликованные в 2018 году в изданиях, проиндексированных в Web of Science и Scopus (квартили 1 и 2). Благодарим наших пользователей за высокие научные результаты и упоминание в публикациях, что эти результаты получены с использованием суперкомпьютеров МСЦ РАН!
«Selective solvation in cosolvent-modified supercritical carbon dioxide on the example of hydroxycinnamic acids. The role of cosolvent self-association»
Авторы: D.L. Gurina, M.L. Antipova, E.G. Odintsova, V.E. Petrenko
Публикация: The Journal of Supercritical Fluids, 2018. DOI: 10.1016/j.supflu.2018.05.004
«Quantum phase transitions and the degree of nonidentity in the system with two different species of vector bosons»
Авторы: A.M. Belemuk, N.M. Chtchelkatchev, A.V. Mikheyenkov, K.I. Kugel
Публикация: New Journal of Physics, 2018. DOI: 10.1088/1367-2630/aacbba
«First-Principle Study of Phosphine Adsorption on Si(001)-2 × 1-Cl»
Авторы: T.V. Pavlova, G.M. Zhidomirov, K.N. Eltsov
Публикация: Journal of Physical Chemistry C, 2018. DOI: 10.1021/acs.jpcc.7b11519
«Influence of crystal structure and 3d impurities on the electronic structure of the topological material Cd3As2»
Авторы: N.M. Shchelkachev, V.G. Yarzhemsky
Публикация: Inorganic Materials, 2018. DOI: 10.1134/S0020168518110110
«Molecular dynamics simulations of single siloxane dendrimers: Molecular structure and intramolecular mobility of terminal groups»
Авторы: A.O. Kurbatov, N.K. Balabaev, M.A. Mazo, E.Yu. Kramarenko
Публикация: The Journal of Chemical Physics, 2018. DOI: 10.1063/1.5009988
«Adsorption of molecular oxygen on the Ag(111) surface: A combined temperature-programmed desorption and scanning tunneling microscopy study»
Авторы: B.V. Andryushechkin, V.M. Shevlyuga, T.V. Pavlova, G.M. Zhidomirov, K.N. Eltsov
Публикация: Journal of Chemical Physics, 2018. DOI: 10.1063/1.5037169
«Adsorption of molecular oxygen on the Ag(111) surface: A combined temperature-programmed desorption and scanning tunneling microscopy study»
Авторы: B.V. Andryushechkin, V.M. Shevlyuga, T.V. Pavlova, G.M. Zhidomirov, K.N. Eltsov
Journal of Chemical Physics, 2018. DOI: 10.1063/1.5037169
«Helical quantum states in a strongly frustrated two-dimensional magnet»
Авторы: A.V. Mikheenkov, V.E. Valiulin, A.V. Shvartsberg, A.F. Barabanov
Публикация: Journal of Experimental and Theoretical Physics, 2018. DOI: 10.1134/S1063776118030147
«Complex crystalline structures in a two-dimensional core-softened system»
Авторы: N.P. Kryuchkov, S.O. Yurchenko, Y.D. Fomin, E.N. Tsiok, V.N. Ryzhov
Публикация: Soft Matter, 2018. DOI: 10.1039/c7sm02429k
«STM and DFT Study of Chlorine Adsorption on the Ag(111)-p(4×4)-O Surface»
Авторы: B.V. Andryushechkin, V.M. Shevlyuga, T.V. Pavlova, G.M. Zhidomirov, K.N. Eltsov
Публикация: Journal of Physical Chemistry C, 2018. DOI: 10.1021/acs.jpcc.8b10443
«Molecular Dynamics Simulation of Nanostructure of High Free Volume Polymers with SiMe3 Side Groups»
Авторы: M. Mazo, N. Balabaev, A. Alentiev, Yu. Yampolskii
Публикация: Macromolecules, 2018. DOI: 10.1021/acs.macromol.7b02470
«A comparative study of intramolecular mobility of single siloxane and carbosilane dendrimers via molecular dynamics simulations»
Авторы: A.O. Kurbatov, N.K. Balabaev, M.A. Mazo, E.Yu. Kramarenko
Публикация: Polymers, 2018. DOI: 10.3390/polym10080838
«Dynamics, thermodynamics and structure of liquids and supercritical fluids: crossover at the Frenkel line»
Авторы: Yu.D. Fomin, V.N. Ryzhov, E.N. Tsiok, J.E. Proctor, C. Prescher, V.B. Prakapenka, K. Trachenko, V.V. Brazhkin
Публикация: Journal of Physics: Condensed Matter, 2018. DOI: 10.1088/1361-648X/aaaf39
«Lateral terahertz hot-electron bolometer based on an array of Sn nanothreads in GaAs»
Авторы: D.S. Ponomarev, D.V. Lavrukhin, A.E. Yachmenev, R.A. Khabibullin, I. Semenikhin, V.V. Vyurkov, M. Ryzhii, T. Otsuji, V. Ryzhii
Публикация: Journal of Physics D: Applied Physics, 2018. DOI: 10.1088/1361-6463/aab11d
«Novel non – covalent supramolecular systems based on zinc(II) bis(dipyrromethenate)s with fullerenes»
Авторы: A.A. Ksenofontov, N.G. Bichan, I.A. Khodov, E.V. Antina, M.B. Berezin, A.I. Vyugin
Публикация: Journal of Molecular Liquids, 2018. DOI: 10.1016/j.molliq.2018.08.069
«Random pinning elucidates the nature of melting transition in two-dimensional core-softened potential system»
Авторы: E.N. Tsiok, Y.D. Fomin, V.N. Ryzhov
Публикация: Physica A: Statistical Mechanics and its Applications, 2018. DOI: 10.1016/j.physa.2017.08.042
«Synthesis and properties of the novel (tetraazaporphinato)/(phthalocyaninato) manganese(III) – Pyridyl-substituted [60]fulleropyrrolidine dyads assembled through donor–acceptor bonding»
Авторы: E.N. Ovchenkova, N.G. Bichan, N.O. Kudryakova, A.A. Ksenofontov, T.N. Lomova
Публикация: Dyes and Pigments, 2018. DOI: 10.1016/j.dyepig.2018.02.023
«Magnetic, electronic, and transport properties of the high-pressure-synthesized chiral magnets Mn1-xRhxGe»
Авторы: V.A. Sidorov, A.E. Petrova, N.M. Chtchelkatchev, M.V. Magnitskaya, L.N. Fomicheva, D.A. Salamatin, A.V. Nikolaev, I.P. Zibrov, F. Wilhelm, A. Rogalev, A.V. Tsvyashchenko
Публикация: Physical Review B, 2018. DOI: 10.1103/PhysRevB.98.125121
«Liquid-like and gas-like features of a simple fluid: An insight from theory and simulation»
Авторы: V.V. Brazhkin, Yu.D. Fomin, V.N. Ryzhov, E.N. Tsiok, K. Trachenko
Публикация: Physica A: Statistical Mechanics and its Applications, 2018. DOI: 10.1016/j.physa.2018.06.084
«Polytetrahedral structure and glass-forming ability of simulated Ni–Zr alloys»
Авторы: B.A. Klumov, R.E. Ryltsev, N.M. Chtchelkatchev
Публикация: Journal of Chemical Physics, 2018. DOI: 10.1063/1.5041325
«The phase diagram and melting scenarios of two-dimensional Hertzian spheres»
Авторы: Yu.D. Fomin, E.A. Gaiduk, E.N. Tsiok, V.N. Ryzhov,
Публикация: Molecular Physics, 2018. DOI: 10.1080/00268976.2018.1464676
«Self-assembled cobalt(ii)porphyrin-fulleropyrrolidine triads: Via axial coordination with photoinduced electron transfer»
Авторы: N.G. Bichan, E.N. Ovchenkova, N.O. Kudryakova, A.A. Ksenofontov, M.S. Gruzdev, T.N. Lomova
Публикация: New Journal of Chemistry, 2018. DOI: 10.1039/c8nj00887f
«Anomalously high heat capacity of liquids: relation to structural properties»
Автор: Yu.D. Fomin
Публикация: Molecular Physics, 2018. DOI: 10.1080/00268976.2018.1552801
«Bright luminescence of diamonds with Ge-V centers»
Авторы: K.N. Boldyrev, B.N. Mavrin, P.S. Sherin, M.N. Popova
Публикация: Journal of Luminescence, 2018. DOI: 10.1016/j.jlumin.2017.07.031
«Band and Impurity States in Dimond with the (MV)– (M = Si, Ge, Sn) Centers Based on ab Initio Calculations»
Автор: B.N. Mavrin
Публикация: Journal of Experimental and Theoretical Physics, 2018. DOI: 10.1134/S1063776118120208
«Compact Modeling Framework v3.0 for high-resolution global ocean-ice-atmosphere models»
Авторы: V.V. Kalmykov, R.A. Ibrayev, M.N. Kaurkin, K.V. Ushakov
Публикация: Geoscientific Model Development, 2018. DOI: 10.5194/gmd-11-3983-2018
«Application of event-driven molecular dynamics approach to rarefied gas dynamics problems»
Авторы: A.N. Yakunchikov, V.V. Kosyanchuk
Публикация: Computers and Fluids, 2018. DOI: 10.1016/j.compfluid.2018.05.002
«Simulation of gas separation effect in microchannel with moving walls»
Авторы: V.V. Kosyanchuk, A.N. Yakunchikov
Публикация: Microfluidics and Nanofluidics, 2018. DOI: 10.1007/s10404-018-2079-8
«DFT calculation of molecular structures of Al2Fe3 and Al2Cu3 heterobinuclear clusters»
Авторы: D.V. Mikhailov, D.V. Chachkov
Публикация: Structural Chemistry, 2018. DOI: 10.1007/s11224-018-1146-9
«IR spectroscopy as a source of data on bond strengths»
Авторы: E.I. Finkelshtein, R.S. Shamsiev
Публикация: Journal of Molecular Structure, 2018. DOI: 10.1016/j.molstruc.2017.10.030
«Adsorption of phenylacetylene and styrene on palladium surface: a DFT study»
Авторы: R.S. Shamsiev, E.I. Finkelshtein
Публикация: Journal of Molecular Modeling, 2018. DOI: 10.1007/s00894-018-3685-9
«Ion Coulomb crystal in a polychromatic optical superlattice»
Авторы: I.V. Krasnov, L.P. Kamenshchikov
Публикация: Laser Physics, 2018. DOI: 10.1088/1555-6611/aaceee
«A random walk on spheres based kinetic Monte Carlo method for simulation of the fluctuation-limited bimolecular reactions»
Автор: K.K. Sabelfeld
Публикация: Mathematics and Computers in Simulation, 2018. DOI: 10.1016/j.matcom.2016.03.011
«Dark matter component decaying after recombination: Sensitivity to BAO and RSD probes»
Авторы: A. Chudaykin, D. Gorbunov, I. Tkachev
Публикация: Physical Review D, 2018. DOI: 10.1103/PhysRevD.97.083508
«Sawtooth mixing of alphas, knock-on D, and T ions, and its influence on NPA spectra in ITER plasma»
Авторы: M.I. Mironov, F.S. Zaitsev, N.N. Gorelenkov, V.I. Afanasyev, F.V. Chernyshev, V.G. Nesenevich, M.P. Petrov
Публикация: Nuclear Fusion, 2018. DOI: 10.1088/1741-4326/aab678
«Integrative computational modeling of the lymph node stromal cell landscape»
Авторы: M. Novkovic, L. Onder, H.-W. Cheng, G. Bocharov, B. Ludewig
Публикация: Frontiers in Immunology, 2018. DOI: 10.3389/fimmu.2018.02428
«Study of volume and surface plasmons in small silicon-hydrogen nanoclusters using the GW method»
Автор: N.L. Matsko
Публикация: Physical chemistry chemical physics, 2018. DOI: 10.1039/c8cp04521f
«Parallel implementation of a three-dimensional cellular automaton model of the electrochemical oxidation of carbon “Ketjenblack EC-600JD”»,
Авторы: K.K. Sabelfeld, A.E. Kireeva, E.N. Gribov, N.V. Maltseva
Публикация: The Journal of Supercomputing, 2018. DOI: 10.1007/s11227-018-2474-7
«Implementation of a 3D model heat equation using fragmented programming technology»
Авторы: D. Akhmed-Zaki, D. Lebedev, V. Perepelkin
Публикация: The Journal of Supercomputing, 2018. DOI: 10.1007/s11227-018-2710-1
«Using spiral chain models for study of nanoscroll structures»
Авторы: A.V. Savin, R.A. Sakovich, M.A. Mazo
Публикация: Physical Review B, 2018. DOI: 10.1103/PhysRevB.97.165436
«The Basic Components of Software-Hardware System for Modeling and Control of the Toroidal Plasma by Epsilon-Nets on Heterogeneous Mini-Supercomputers»
Авторы: F.S. Zaitsev, A.G. Shishkin, A.A. Lukianitsa, E.P. Suchkov, S.V. Stepanov, F.A. Anikeev
Публикация: Communications in Computational Physics, 2018. DOI: 10.4208/cicp.OA-2017-0079
«Interplay between reaction and diffusion processes in governing the dynamics of virus infections»
Авторы: G. Bocharov, A. Meyerhans, N.Bessonov, S. Trofimchuk, V. Volpert
Публикация: Journal of Theoretical Biology, 2018. DOI: 10.1016/j.jtbi.2018.08.036
«Spin ordering in oxide nanoclusters without magnetic element atoms»
Авторы: V.S. Baturin, Yu.A. Uspenskii, S.V. Lepeshkin, N.A. Fokina, E.V. Tikhonov
Публикация: Journal of Magnetism and Magnetic Materials, 2018. DOI: 10.1016/j.jmmm.2017.10.073
«Stochastic models of atmospheric clouds structure»
Авторы: V.A. Ogorodnikov, E.G. Kablukova , S.M. Prigarin
Публикация: Statistical Papers, 2018. DOI: 10.1007/s00362-018-1036-7
«Supercomputer Simulation of Social Processes: New Technologies»
Авторы: V.L. Makarov, A.R. Bakhtizin, E.D. Sushko, G.B. Sushko
Публикация: Herald of the Russian Academy of Sciences, 2018. DOI: 10.1134/S1019331618030139
«Self-generated surface magnetic fields inhibit laser-driven sheath acceleration of high-energy protons»
Авторы: M. Nakatsutsumi, Y. Sentoku, A. Korzhimanov, S. N. Chen, S. Buffechoux, A. Kon, B. Atherton, P. Audebert, M. Geissel, etc.
Публикация: Nature Communications, 2018. DOI: 10.1038/s41467-017-02436-w
«Amide-imide tautomerization in the glutamine side chain in enzymatic and photochemical reactions in proteins»
Авторы: B.L. Grigorenko, M.G. Khrenova, A.V. Nemukhin
Публикация: Physical Chemistry Chemical Physics, 2018. DOI: 10.1039/c8cp04817g
«Monomerization of the photoconvertible fluorescent protein SAASoti by rational mutagenesis of single amino acids»
Авторы: I.D. Solovyev, A.V. Gavshina, A.S. Katti, A.I. Chizhik, L.M. Vinokurov, G.D. Lapshin, T.V. Ivashina, M.G. Khrenova, etc.
Публикация: Scientific Reports, 2018. DOI: 10.1038/s41598-018-33250-z
«Competition between two cysteines in covalent binding of biliverdin to phytochrome domains»
Авторы: M.G. Khrenova, A.M. Kulakova, A.V. Nemukhin
Публикация: Organic & Biomolecular Chemistry, 2018. DOI: 10.1039/c8ob02262c
«Towards first-principles calculation of electronic excitations in the ring of the protein-bound bacteriochlorophylls»
Авторы: I.V. Polyakov, M.G. Khrenova, A.A. Moskovsky, B.M. Shabanov, A.V. Nemukhin
Публикация: Chemical Physics, 2018. DOI: 10.1016/j.chemphys.2018.03.009
«Matrix isolation and ab initio study on the CHF3…CO complex.»
Авторы: I.S. Sosulin, E.S. Shiryaeva, D.A. Tyurin, V.I. Feldman
Публикация: Journal of Physical Chemistry A, 2018. DOI: 10.1021/acs.jpca.8b01485
«CHF3…H2O complex revisited: a matrix isolation and ab initio study.»
Авторы: I.S. Sosulin, D.A. Tyurin, V.I. Feldman
Structural Chemistry, 2018. DOI: 10.1007/s11224-018-1232-z
«Multilevel parallelization for simulating turbulent flows on most kinds of hybrid supercomputers.»
Авторы: A. Gorobets, S. Soukov, P. Bogdanov
Публикация: Computers & Fluids, 2018. DOI: 10.1016/j.compfluid.2018.03.011
«HPC2 – a fully portable algebra-dominant framework for heterogeneous computing. Application to CFD.»
Авторы: X. Alvarez, A. Gorobets, F.X. Trias, R. Borrell, G. Oyarzun
Публикация: Computers & Fluids, 2018. DOI: 10.1016/j.compfluid.2018.01.034
«Probing the effect of membrane contents on transmembrane protein-protein interaction using solution NMR and computer simulations.»
Авторы: P.E. Bragin, A.S. Kuznetsov, O.V. Bocharova, P.E. Volynsky, A.S. Arseniev, R.G. Efremov, K.S. Mineev
Публикация: Biochimica et Biophysica Acta – Biomembranes, 2018. DOI: 10.1016/j.bbamem.2018.09.013
«Kv1.2 channel-specific blocker from Mesobuthus eupeus scorpion venom: structural basis of selectivity.»
Авторы: A.I. Kuzmenkov, O.V. Nekrasova, S. Peigneur, V.M. Tabakmakher, A.M. Gigolaev, A.F. Fradkov, K.S. Kudryashova, A.O. Chugunov, R.G. Efremov
Публикация: Neuropharmacology, 2018. DOI: 10.1016/j.neuropharm.2018.09.030
«Monomeric aluminum complex based on A3B-type mono-hydroxyfunctionalized phthalocyanine and its stable supramolecular J-type dimer: Selective synthesis and physicochemical properties.»
Авторы: Yu.S. Korostei, A.Yu. Tolbin, A.V. Dzuban, V.E. Pushkarev, M.V. Sedova, S.S. Maklakov, L.G. Tomilova
Dyes and Pigments, 2018. DOI: 10.1016/j.dyepig.2017.09.066
«A mathematical analysis of deviations from linearity of Beer’s law.»
Авторы: A.Yu. Tolbin, V.E. Pushkarev, L.G. Tomilova
Публикация: Chemical Physics Letters, 2018. DOI: 10.1016/j.cplett.2018.06.056
«Aggregation of slipped-cofacial phthalocyanine J-type dimers: Spectroscopic and AFM study.»
Авторы: A.Yu. Tolbin, V.E. Pushkarev, M.V. Sedova, S.S. Maklakov, L.G. Tomilova
Публикация: Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 2018. DOI: 10.1016/j.saa.2018.07.052
«When Applying the Mercury Poisoning Test to Palladacycle-Catalyzed Reactions, One Should Not Consider the Common Misconception of Mercury(0) Selectivity.»,
Авторы: O.N. Gorunova, I.M. Novitskiy, Yu.K. Grishin, I.P. Gloriozov, V.A. Roznyatovsky, V.N. Khrustalev, K.A. Kochetkov, V.V. Dunina
Публикация: Organometallics, 2018. DOI: 10.1021/acs.organomet.8b00363
«1,6-Methano[10]annulene as prospective organometallic ligand from the annulene family: A DFT study of transition metal π-complexes and their inter-ring haptotropic rearrangements.»
Авторы: I.P. Gloriozov, N.S. Zhulyaev, F. Gam, J.-Y. Saillard, Y.F. Oprunenko
Публикация: Journal of Organometallic Chemistry, 2018. DOI: 10.1016/j.jorganchem.2017.11.023
«Direct Oxidation of Cyclopropanated Cyclooctanes as a Synthetic Approach to Polycyclic Cyclopropyl Ketones.»
Авторы: K.N. Sedenkova, K.S. Andriasov, S.A. Stepanova, I.P. Gloriozov, Y.K. Grishin, T.S. Kuznetsova, E.B. Averina
Публикация: European Journal of Organic Chemistry, 2018. DOI: 10.1002/ejoc.201701671
«The molecular structure and absorption spectrum of hydroxy substituted dibenzoylmethanatoboron difluoride in solution: A theoretical and experimental study.»
Авторы: N. Gelfand, A. Freidzon, E. Fedorenko
Публикация: Journal of Molecular Structure, 2018. DOI: 10.1016/j.molstruc.2017.09.045
«Simulation of observed climate changes in 1850-2014 with climate model INM-CM5.»
Авторы: E.M. Volodin, A.S. Gritsun
Публикация: Earth System Dynamics, 2018. DOI: 10.5194/esd-9-1235-2018
«Ab initio calculation of energy levels of trivalent lanthanide ions.»
Авторы: A.Ya. Freidzon, I.A. Kurbatov, V.I. Vovna
Публикация: Physical Chemistry Chemical Physics, 2018. DOI: 10.1039/c7cp08366a
«Causes of the double maximum conductivity of nanocomposite polymer electrolytes for lithium power sources.»
Авторы: O.V. Yarmolenko, K.G. Khatmullina, G.R. Baymuratova, G.Z. Tulibaeva, L.M. Bogdanova, A.F. Shestakov
Публикация: Mendeleev Communications, 2018. DOI: 10.1016/j.mencom.2018.01.013
«Theoretical study of the structure and specific capacity of an organic cathode based on poly(2,5-diaza-1,4-benzoquinone) in a lithiated state.»
Авторы: A.F. Shestakov, M.A. Litvinenko, K.J. Stevenson
Публикация: Mendeleev Communications, 2018. DOI: 10.1016/j.mencom.2018.05.003
«Theoretical study of N-2 coordination in metal complexes with fullerene ligands.»
Автор: A.F. Shestakov
Публикация: Mendeleev Communications, 2018. DOI: 10.1016/j.mencom.2018.03.022
«Molecular Structure, Optical and Magnetic Properties of Dianionic Free-Base Tetrapyrazinoporphyrazine Macrocycle.»
Авторы: D.V. Konarev, M.A. Faraonov, A.V. Kuzmin, A.M. Fatalov, N.G. Osipov, S.S. Khasanov, A.F. Shestakov, R.N. Lyubovskaya
Публикация: ChemistrySelect, 2018. DOI: 10.1002/slct.201800739
«Solid State Structure, and Optical and Magnetic Properties, of Free Base Tetra(4-pyridyl)porphyrin {H2T(4-Py)P center dot- Radical Anions.»
Авторы: D.V. Konarev, A.V. Kuzmin, S.S. Khasanov, A.F. Shestakov, E.I. Yudanova, A. Otsuka, H. Yamochi, H. Kitagawa, et al.
Публикация: Journal of Organic Chemistry, 2018. DOI: 10.1021/acs.joc.7b02791
«Interligand Charge Transfer in a Complex of Deprotonated cis-Indigo Dianions and Tin(II) Phthalocyanine Radical Anions with Cp*Ir-III.»
Авторы: D.V. Konarev, L.V. Zorina, S.S. Khasanov, A.F. Shestakov, A.M. Fatalov, A. Otsuka, H. Yamochi, H. Kitagawa, et al.
Публикация: Inorganic Chemistry, 2018. DOI: 10.1021/acs.inorgchem.7b02351
«Molecular Structure, Optical, and Magnetic Properties of Free-Base Naphthalocyanine Dianions.»
Авторы: D.V. Konarev, S.S. Khasanov, A.F. Shestakov, Y. Nakano, M. Ishikawa , A. Otsuka , H. Yamochi, H. Kitagawa, et al.
Публикация: European Journal of Organic Chemistry, 2018. DOI: 10.1002/ejoc.201800364
«Reaction of tin(IV) phthalocyanine dichloride with decamethylmetallocenes (M = CrII and CoII). Strong magnetic coupling of spins in (Cp*2Co+){SnIVCl2(Pc˙3−)}˙−·2C6H4Cl2»
Авторы: D.V. Konarev, S.I. Troyanov, A.F. Shestakov, E.I. Yudanova, A. Otsuka, H. Yamochi, H. Kitagawa, R.N. Lyubovskaya
Публикация: Dalton Transactions, 2018. DOI: 10.1039/c7dt03807k
«Plasma phase transition in warm dense hydrogen.»
Авторы: G.E. Norman, I.M. Saitov
Публикация: Contributions to plasma physics, 2018. DOI: 10.1002/ctpp.201700101
«Application of model kinetic equations to hypersonic rarefied gas flows.»
Автор: V.A Titarev
Публикация: Computers & Fluids, 2018. DOI: 10.1016/j.compfluid.2017.06.019
«Effect of solvents on the behavior of lithium and superoxide ions in Li-O2 battery electrolyte.»
Авторы: V.S. Smirnov, S.A. Kislenko
Публикация: ChemPhysChem, 2018. DOI: 10.1002/cphc.201700980
«On the mechanism of flow evolution in shock-tube experiments.»
Авторы: A.D. Kiverin, I.S. Yakovenko
Публикация: Physics Letters A, 2018. DOI: 10.1016/j.physleta.2017.11.033
«Control of flow around a cylinder by rotary oscillations at a high subcritical Reynolds number.»
Авторы: E. Palkin, M. Hadžiabdić, R. Mullyadzhanov, K. Hanjalić
Публикация: Journal of Fluid Mechanics, 2018. DOI: 10.1017/jfm.2018.639
«Numerical simulations of mixed convection in liquid metal flow within a horizontal pipe with transverse magnetic field.»
Авторы: Y. Listratov, D. Ognerubov, O. Zikanov, V. Sviridov
Публикация: Fluid Dynamics Research, 2018. DOI: 10.1088/1873-7005/aab382
«New interatomic potential for simulation of pure magnesium and magnesium hydrides.»
Авторы: D. Smirnova, S. Starikov, A. Vlasova
Публикация: Computational Materials Science, 2018. DOI: 10.1016/j.commatsci.2018.07.051
«Evaluation of the structure and properties for the high-temperature phase of zirconium from the atomistic simulations.»
Авторы: D.E. Smirnova, S.V. Starikov, I.S. Gordeev
Публикация: Computational Materials Science, 2018. DOI: 10.1016/j.commatsci.2018.05.025
«Description of phase transitions through accumulation of point defects: UN, UO2 and UC»
Авторы: S. Starikov, M. Korneva
Публикация: Journal of Nuclear Materials, 2018. DOI: 10.1016/j.jnucmat.2018.08.025
«Understanding thermally-activated glide of 1/2 110{110} screw dislocations in UO2 – A molecular dynamics analysis.»
Авторы: A.V. Lunev, S.V. Starikov, T.N. Aliev, V.I. Tseplyaev
Публикация: International Journal of Plasticity, 2018. DOI: 10.1016/j.ijplas.2018.07.003
«Atomistic simulation of Si-Au melt crystallization with novel interatomic potential»
Авторы: S.V. Starikov, N.Y. Lopanitsyna, D.E. Smirnova, S.V. Makarov
Публикация: Computational Materials Science, 2018. DOI: 10.1016/j.commatsci.2017.09.054
«Recent Progress on Supercomputer Modeling of High-Speed Rarefied Gas Flows Using Kinetic Equations»
Авторы: A.A. Frolova, V.A. Titarev
Публикация: Supercomputing frontiers and innovations, 2018. DOI: 10.14529/jsfi180322