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Daria Smirnova
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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
1092011
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
992013
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
602015
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
542018
An interatomic potential for simulation of Zr-Nb system
DE Smirnova, SV Starikov
Computational Materials Science 129, 259-272, 2017
542017
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
472015
Molecular-dynamic simulation of the thermophysical properties of liquid uranium
DK Belashchenko, DE Smirnova, OI Ostrovski
High Temperature 48 (3), 363-375, 2010
432010
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
402021
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
392015
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
352016
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
332019
Calculation of diffusion coefficients of defects and ions in UO2
AY Kuksin, DE Smirnova
Physics of the Solid State 56, 1214-1223, 2014
292014
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
282018
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
262020
Optimized interatomic potential for atomistic simulation of Zr-Nb alloy
S Starikov, D Smirnova
Computational Materials Science 197, 110581, 2021
242021
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
222018
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
212011
New interatomic potential for simulation of pure magnesium and magnesium hydrides
DE Smirnova, SV Starikov, AM Vlasova
Computational Materials Science 154, 295-302, 2018
202018
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
172012
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
92022
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