Interatomic potential for uranium in a wide range of pressures and temperatures DE Smirnova, SV Starikov, VV Stegailov Journal of Physics: Condensed Matter 24 (1), 015702, 2011 | 112 | 2011 |
A ternary EAM interatomic potential for U–Mo alloys with xenon DE Smirnova, AY Kuksin, SV Starikov, VV Stegailov, Z Insepov, J Rest, ... Modelling and Simulation in Materials Science and Engineering 21 (3), 035011, 2013 | 106 | 2013 |
Atomistic simulation of cubic and tetragonal phases of U-Mo alloy: Structure and thermodynamic properties SV Starikov, LN Kolotova, AY Kuksin, DE Smirnova, VI Tseplyaev Journal of nuclear materials 499, 451-463, 2018 | 68 | 2018 |
Investigation of point defects diffusion in bcc uranium and U–Mo alloys DE Smirnova, AY Kuksin, SV Starikov Journal of Nuclear Materials 458, 304-311, 2015 | 65 | 2015 |
An interatomic potential for simulation of Zr-Nb system DE Smirnova, SV Starikov Computational Materials Science 129, 259-272, 2017 | 61 | 2017 |
Angular-dependent interatomic potential for large-scale atomistic simulation of iron: Development and comprehensive comparison with existing interatomic models S Starikov, D Smirnova, T Pradhan, Y Lysogorskiy, H Chapman, ... Physical Review Materials 5 (6), 063607, 2021 | 51 | 2021 |
Development of the advanced mechanistic fuel performance and safety code using the multi-scale approach MS Veshchunov, AV Boldyrev, AV Kuznetsov, VD Ozrin, MS Seryi, ... Nuclear Engineering and Design 295, 116-126, 2015 | 49 | 2015 |
Molecular-dynamic simulation of the thermophysical properties of liquid uranium DK Belashchenko, DE Smirnova, OI Ostrovski High Temperature 48 (3), 363-375, 2010 | 47 | 2010 |
Atomistic modeling of the self-diffusion in γ-U and γ-U-Mo DE Smirnova, AY Kuksin, SV Starikov, VV Stegailov The Physics of Metals and Metallography 116, 445-455, 2015 | 41 | 2015 |
The diffusion of point defects in uranium mononitride: Combination of DFT and atomistic simulation with novel potential AY Kuksin, SV Starikov, DE Smirnova, VI Tseplyaev Journal of Alloys and Compounds 658, 385-394, 2016 | 40 | 2016 |
Superioniclike diffusion in an elemental crystal: bcc titanium DG Sangiovanni, J Klarbring, D Smirnova, NV Skripnyak, D Gambino, ... Physical review letters 123 (10), 105501, 2019 | 35 | 2019 |
Optimized interatomic potential for atomistic simulation of Zr-Nb alloy S Starikov, D Smirnova Computational Materials Science 197, 110581, 2021 | 34 | 2021 |
Atomistic simulation of Si-Au melt crystallization with novel interatomic potential SV Starikov, NY Lopanitsyna, DE Smirnova, SV Makarov Computational Materials Science 142, 303-311, 2018 | 31 | 2018 |
Atomistic description of self-diffusion in molybdenum: A comparative theoretical study of non-Arrhenius behavior D Smirnova, S Starikov, GD Leines, Y Liang, N Wang, MN Popov, ... Physical Review Materials 4 (1), 013605, 2020 | 30 | 2020 |
Calculation of diffusion coefficients of defects and ions in UO2 AY Kuksin, DE Smirnova Physics of the Solid State 56, 1214-1223, 2014 | 30 | 2014 |
New interatomic potential for simulation of pure magnesium and magnesium hydrides DE Smirnova, SV Starikov, AM Vlasova Computational Materials Science 154, 295-302, 2018 | 25 | 2018 |
Evaluation of the structure and properties for the high-temperature phase of zirconium from the atomistic simulations DE Smirnova, SV Starikov, IS Gordeev Computational Materials Science 152, 51-59, 2018 | 23 | 2018 |
Modeling the molecular dynamics of liquid metals at high pressures: Liquid potassium DK Belashchenko, DE Smirnova Russian Journal of Physical Chemistry A 85, 1908-1916, 2011 | 21 | 2011 |
New interatomic potential for computation of mechanical and thermodynamic properties of uranium in a wide range of pressures and temperatures DE Smirnova, SV Starikov, VV Stegailov The Physics of Metals and Metallography 113, 107-116, 2012 | 18 | 2012 |
Angular-dependent interatomic potential for large-scale atomistic simulation of the Fe-Cr-H ternary system S Starikov, D Smirnova, T Pradhan, I Gordeev, R Drautz, M Mrovec Physical Review Materials 6 (4), 043604, 2022 | 11 | 2022 |