| Technetium and Rhenium Pentacarbonyl Complexes with C2 and C11 ω-Isocyanocarboxylic Acid Esters AE Miroslavov, YS Polotskii, VV Gurzhiy, AY Ivanov, AA Lumpov, ... Inorganic Chemistry 53 (15), 7861-7869, 2014 | 35 | 2014 |
| Compound-tunable embedding potential: which oxidation state of uranium and thorium as point defects in xenotime is favorable? YV Lomachuk, DA Maltsev, NS Mosyagin, LV Skripnikov, RV Bogdanov, ... Physical Chemistry Chemical Physics 22 (32), 17922-17931, 2020 | 27 | 2020 |
| Compound-tunable embedding potential method and its application to calcium niobate crystal with point defects containing tantalum and uranium DA Maltsev, YV Lomachuk, VM Shakhova, NS Mosyagin, LV Skripnikov, ... Physical Review B 103 (20), 205105, 2021 | 25 | 2021 |
| Reaction of technetium hexacarbonyl cation with acetonitrile: Kinetics, product structure, DFT calculations AE Miroslavov, GV Sidorenko, AA Lumpov, DN Suglobov, OV Sizova, ... Journal of Organometallic Chemistry 720, 1-6, 2012 | 23 | 2012 |
| Compound-tunable embedding potential method: analysis of pseudopotentials for Yb in YbF 2, YbF 3, YbCl 2 and YbCl 3 crystals VM Shakhova, DA Maltsev, YV Lomachuk, NS Mosyagin, LV Skripnikov, ... Physical Chemistry Chemical Physics 24 (32), 19333-19345, 2022 | 21 | 2022 |
| Hydrolysis of Hexacarbonyltechnetium(I) Cation: Formation and Structure of Technetium Carbonyl Hydride 99Tc3H(CO)14 AE Miroslavov, AP Shishkina, GV Sidorenko, VV Gurzhiy, DA Maltsev, ... Inorganic Chemistry 59 (13), 9239-9243, 2020 | 13 | 2020 |
| Compound-tunable embedding potential method to model local electronic excitations on -element ions in solids: Pilot relativistic coupled cluster study of Ce and Th … AV Oleynichenko, YV Lomachuk, DA Maltsev, NS Mosyagin, ... Physical Review B 109 (12), 125106, 2024 | 11 | 2024 |
| Reactivity of higher technetium carbonyls in CO replacement: a quantum chemical analysis GV Sidorenko, DA Maltsev, AE Miroslavov, DN Suglobov, VI Baranovskii, ... Computational and Theoretical Chemistry 1093, 55-66, 2016 | 10 | 2016 |
| DFT study of potential energy surfaces and conical intersection structures of rhenium (I) tricarbonyl diimine complexes VI Baranovskii, DA Maltsev Computational and Theoretical Chemistry 1043, 71-78, 2014 | 10 | 2014 |
| Reactivity of Tc (I) tetracarbonyl complexes GV Sidorenko, AE Miroslavov, DA Maltsev, AA Lumpov, YS Polotskii, ... Radiochemistry 56 (2), 156-161, 2014 | 4* | 2014 |
| Excited-state potential surfaces of ruthenium nitrosyl complexes: conical intersections and the Jahn-Teller effect VI Baranovskii, DA Mal’tsev, OV Sizova Russian Chemical Bulletin 61 (5), 973-979, 2012 | 4 | 2012 |
| Calculations of chemical shifts of x-ray emission spectra and effective states of Nb atom in the Niobates YV Lomachuk, DA Maltsev, YA Demidov, NS Mosyagin, LA Batalov, ... Nonlinear Phenomena in Complex Systems 20 (2), 170, 2017 | 3 | 2017 |
| Specific features of the cis labilization effect in the series of pentacarbonyltechnetium halides GV Sidorenko, DA Maltsev, AE Miroslavov, ES Stepanova, MY Tyupina, ... Radiochemistry 59 (3), 240-246, 2017 | 2 | 2017 |
| Compound-tunable embedding potential method and its application to ytterbium fluoride crystals YbF and YbF VM Shakhova, DA Maltsev, YV Lomachuk, NS Mosyagin, LV Skripnikov, ... arXiv preprint arXiv:1911.04332, 2019 | 1 | 2019 |
| Application of discrete-continuum solvation model in a quantum chemical study of technetium (I) pentacarbonyl bromide decarbonylation DA Mal’tsev, VI Baranovskii Journal of Structural Chemistry 55 (5), 816-821, 2014 | 1 | 2014 |
| Electronic structure study of YNbTiO and CaNb O with actinide impurities using compound-tunable embedding potential method D Maltsev, Y Lomachuk, V Shakhova, N Mosyagin, D Kozina, A Titov Scientific Reports 15 (1), 10645, 2025 | | 2025 |
| Electronic structure study of YNbTiO [Formula: see text] and CaNb [Formula: see text] O [Formula: see text] with actinide impurities using compound-tunable embedding potential … D Maltsev, Y Lomachuk, V Shakhova, N Mosyagin, D Kozina, A Titov Scientific Reports 15 (1), 10645-10645, 2025 | | 2025 |
| Electronic structure study of YNbTiO [equation] and CaNb [equation] O [equation] with actinide impurities using compound-tunable embedding potential method D Maltsev, Y Lomachuk, V Shakhova, N Mosyagin, D Kozina, A Titov Scientific Reports 15, 10645, 2025 | | 2025 |
| Electronic structure study of YNbTiO vs. CaNbO with U, Pu and minor actinide substitutions using compound-tunable embedding potential method DA Maltsev, YV Lomachuk, VM Shakhova, NS Mosyagin, DO Kozina, ... arXiv preprint arXiv:2310.20595, 2023 | | 2023 |
| Combined method for precise electronic-structure modeling of compounds of lanthanides and actinides based on the compound-tunable embedding potential AV Titov, VM Shakhova, YV Lomachuk, DA Maltsev, NS Mosyagin | | 2022 |
Anatoly V. TitovHead of division and dept at NRC "Kurchatov institute" - PNPI & Professor of SPbSUVerified email at pnpi.nrcki.ru
