| Method for simultaneous prediction of atomic structure and stability of nanoclusters in a wide area of compositions SV Lepeshkin, VS Baturin, YA Uspenskii, AR Oganov The journal of physical chemistry letters 10 (1), 102-106, 2018 | 48 | 2018 |
| Super-oxidation of silicon nanoclusters: magnetism and reactive oxygen species at the surface S Lepeshkin, V Baturin, E Tikhonov, N Matsko, Y Uspenskii, A Naumova, ... Nanoscale 8 (44), 18616-18620, 2016 | 22 | 2016 |
| Prediction of the atomic structure and stability for the ensemble of silicon nanoclusters passivated by hydrogen VS Baturin, SV Lepeshkin, NL Matsko, AR Oganov, YA Uspenskii Europhysics Letters 106 (3), 37002, 2014 | 18 | 2014 |
| Tetrahedral honeycomb surface reconstructions of quartz, cristobalite and stishovite OD Feya, Q Wang, SV Lepeshkin, VS Baturin, YA Uspenskii, AR Oganov Scientific Reports 8 (1), 11947, 2018 | 13 | 2018 |
| Atomistic origins of charge traps in CdSe nanoclusters V Baturin, S Lepeshkin, N Bushlanova, Y Uspenskii Physical Chemistry Chemical Physics 22 (45), 26299-26305, 2020 | 11 | 2020 |
| The impact of electron correlations on the energetics and stability of silicon nanoclusters NL Matsko, EV Tikhonov, VS Baturin, SV Lepeshkin, AR Oganov The Journal of chemical physics 145 (7), 2016 | 11 | 2016 |
| Influence of the Pd: Bi ratio on Pd–Bi/Al 2 O 3 catalysts: structure, surface and activity in glucose oxidation MP Sandu, MA Kovtunov, VS Baturin, AR Oganov, IA Kurzina Physical Chemistry Chemical Physics 23 (27), 14889-14897, 2021 | 10 | 2021 |
| Structural and electronic properties of small silicon clusters VS Baturin, SV Lepeshkin, MV Magnitskaya, NL Matsko, YA Uspenskii Journal of Physics: Conference Series 510 (1), 012032, 2014 | 9 | 2014 |
| “Magic” Molecules and a New Look at Chemical Diversity of Hydrocarbons SV Lepeshkin, VS Baturin, AS Naumova, AR Oganov The Journal of Physical Chemistry Letters 13 (32), 7600-7606, 2022 | 6 | 2022 |
| The amorphous-crystalline transition in Si n H 2m nanoclusters N Bushlanova, V Baturin, S Lepeshkin, Y Uspenskii Nanoscale 13 (45), 19181-19189, 2021 | 6 | 2021 |
| Ultralow reaction barriers for CO oxidation in Cu–Au nanoclusters AA Mikhailova, SV Lepeshkin, VS Baturin, AP Maltsev, YA Uspenskii, ... Nanoscale 15 (33), 13699-13707, 2023 | 5 | 2023 |
| Phosphorus nanoclusters and insight into the formation of phosphorus allotropes DV Rybkovskiy, SV Lepeshkin, VS Baturin, AA Mikhailova, AR Oganov Nanoscale 15 (3), 1338-1346, 2023 | 5 | 2023 |
| Magnetic nanoribbons with embedded cobalt grown inside single-walled carbon nanotubes DM Krichevsky, L Shi, VS Baturin, DV Rybkovsky, Y Wu, PV Fedotov, ... Nanoscale 14 (5), 1978-1989, 2022 | 4 | 2022 |
| Pressure-induced semimetallic behavior of calcium from ab initio calculations MV Magnitskaya, NL Matsko, VS Baturin, YA Uspenskii Journal of Physics: Conference Series 510 (1), 012028, 2014 | 4 | 2014 |
| Electronic and magnetic properties of high‐pressure phases in the systems Mn–GaSb and Cr–GaSb M Magnitskaya, E Kulatov, V Baturin, Y Uspenskii physica status solidi (c) 11 (5‐6), 1048-1052, 2014 | 3 | 2014 |
| On heat capacity of nanoclusters with a shell structure VS Baturin, VV Losyakov Journal of Experimental and Theoretical Physics 112, 226-231, 2011 | 3 | 2011 |
| Structure and stability of silicon nanoclusters passivated by hydrogen and oxygen: evolutionary algorithm and first-principles study VS Baturin, SV Lepeshkin, NL Matsko, YA Uspenskii Journal of Physics: Conference Series 681 (1), 012037, 2016 | 2 | 2016 |
| Electronic properties and stability of silicon nanoclusters passivated by hydrogen V Baturin, S Lepeshkin, N Matsko, Y Uspenskii Solid State Phenomena 233, 562-566, 2015 | 2 | 2015 |
| Lithiation of phosphorus at the nanoscale: a computational study of Li n P m clusters DV Rybkovskiy, SV Lepeshkin, AA Mikhailova, VS Baturin, AR Oganov Nanoscale 16 (3), 1197-1205, 2024 | 1 | 2024 |
| Spin ordering in oxide nanoclusters without magnetic element atoms VS Baturin, YA Uspenskii, SV Lepeshkin, NA Fokina, EV Tikhonov Journal of Magnetism and Magnetic Materials 459, 272-275, 2018 | 1 | 2018 |
