Vacancy Defects in Ga2O3: First-Principles Calculations of Electronic Structure A Usseinov, Z Koishybayeva, A Platonenko, V Pankratov, Y Suchikova, ... Materials 14 (23), 7384, 2021 | 53 | 2021 |
Atomic, electronic and magnetic structure of an oxygen interstitial in neutron-irradiated Al2O3 single crystals V Seeman, A Lushchik, E Shablonin, G Prieditis, D Gryaznov, ... Scientific reports 10 (1), 15852, 2020 | 24 | 2020 |
First-principles calculations of oxygen interstitials in corundum: a site symmetry approach RA Evarestov, A Platonenko, D Gryaznov, YF Zhukovskii, EA Kotomin Physical Chemistry Chemical Physics 19 (37), 25245-25251, 2017 | 24 | 2017 |
Ab initio simulations on migration paths of interstitial oxygen in corundum YF Zhukovskii, A Platonenko, S Piskunov, EA Kotomin Nuclear Instruments and Methods in Physics Research Section B: Beam …, 2016 | 24 | 2016 |
The effect of pH on polymorph formation of the pharmaceutically active compound tianeptine L Orola, MV Veidis, I Sarcevica, A Actins, S Belyakov, A Platonenko International journal of pharmaceutics 432 (1-2), 50-56, 2012 | 22 | 2012 |
Nitrogen substitutional defects in silicon. A quantum mechanical investigation of the structural, electronic and vibrational properties A Platonenko, FS Gentile, F Pascale, AM Ferrari, M D’amore, R Dovesi Physical Chemistry Chemical Physics 21 (37), 20939-20950, 2019 | 21 | 2019 |
The VN2 negatively charged defect in diamond. A quantum mechanical investigation of the EPR response G Di Palma, B Kirtman, FS Gentile, A Platonenko, AM Ferrari, R Dovesi Carbon 159, 443-450, 2020 | 20 | 2020 |
Ab initio simulations on charged interstitial oxygen migration in corundum A Platonenko, D Gryaznov, YF Zhukovskii, EA Kotomin Nuclear Instruments and Methods in Physics Research Section B: Beam …, 2018 | 18 | 2018 |
Hybrid density functional calculations of hyperfine coupling tensor for hole-type defects in MgAl2O4 A Platonenko, D Gryaznov, EA Kotomin, A Lushchik, V Seeman, AI Popov Nuclear Instruments and Methods in Physics Research Section B: Beam …, 2020 | 16 | 2020 |
First Principles Simulations on Migration Paths of Oxygen Interstitials in MgAl2O4 A Platonenko, D Gryaznov, YF Zhukovskii, EA Kotomin Physica status solidi (b) 256 (5), 1800282, 2019 | 15 | 2019 |
Pair vacancy defects in β-Ga2O3 crystal: Ab initio study A Usseinov, A Platonenko, Z Koishybayeva, A Akilbekov, M Zdorovets, ... Optical Materials: X 16, 100200, 2022 | 14 | 2022 |
Nitrogen interstitial defects in silicon. A quantum mechanical investigation of the structural, electronic and vibrational properties A Platonenko, FS Gentile, J Maul, F Pascale, EA Kotomin, R Dovesi Materials Today Communications 21, 100616, 2019 | 13 | 2019 |
Site symmetry approach applied to the supercell model of MgAl2O4 spinel with oxygen interstitials: ab initio calculations RA Evarestov, A Platonenko, YF Zhukovskii Computational Materials Science 150, 517-523, 2018 | 12 | 2018 |
Interstitial defects in diamond: A quantum mechanical simulation of their EPR constants and vibrational spectra F Colasuonno, FS Gentile, W Mackrodt, AM Ferrari, A Platonenko, ... The Journal of Chemical Physics 153 (2), 2020 | 8 | 2020 |
Substitutional carbon defects in silicon: A quantum mechanical characterization through the infrared and Raman spectra FS Gentile, A Platonenko, KE El‐Kelany, M Rérat, P d'Arco, R Dovesi Journal of Computational Chemistry 41 (17), 1638-1644, 2020 | 8 | 2020 |
Structural and electronic properties of β-NaYF4 and β-NaYF4: Ce3+ A Platonenko, AI Popov Optical Materials 99, 109529, 2020 | 8 | 2020 |
First principles calculations of the vibrational properties of single and dimer F-type centers in corundum crystals A Platonenko, D Gryaznov, AI Popov, R Dovesi, EA Kotomin The Journal of Chemical Physics 153 (13), 2020 | 7 | 2020 |
Self-trapped excitons in diamond: A Δ-SCF approach WC Mackrodt, A Platonenko, R Dovesi The Journal of Chemical Physics 157 (8), 2022 | 5 | 2022 |
Charged oxygen interstitials in corundum: first principles simulations A Platonenko, D Gryaznov, S Piskunov, YF Zhukovskii, EA Kotomin physica status solidi (c) 13 (10‐12), 932-936, 2016 | 5 | 2016 |
Quantum mechanical simulation of various phases of KVF3 perovskite KE El-Kelany, F Pascale, A Platonenko, AM Ferrari, R Dovesi Journal of Physics: Condensed Matter 34 (28), 285401, 2022 | 4 | 2022 |