Eugene A. Kotomin

Overview

Best Publications

• Ab initio modeling of surface structure for SrTiO 3 perovskite crystals

  E. Heifets;R. I. Eglitis;E. A. Kotomin;E. A. Kotomin;J. Maier

  340
  Citations

• Kinetics of bimolecular reactions in condensed media: critical phenomena and microscopic self-organisation

  V Kuzovkov;E Kotomin

  332
  Citations

• Radiation-induced point defects in simple oxides

  E.A. Kotomin;A.I. Popov

  332
  Citations

• Combined theoretical and experimental analysis of processes determining cathode performance in solid oxide fuel cells

  M. M. Kuklja;E. A. Kotomin;E. A. Kotomin;R. Merkle;Yu. A. Mastrikov;Yu. A. Mastrikov

  308
  Citations

• Evidence for interfacial-storage anomaly in nanocomposites for lithium batteries from first-principles simulations.

  Yuri F. Zhukovskii;Yuri F. Zhukovskii;Palani Balaya;Eugene A. Kotomin;Eugene A. Kotomin;Joachim Maier

  258
  Citations

• Hybrid DFT calculations of the atomic and electronic structure for ABO3 perovskite (001) surfaces

  S. Piskunov;S. Piskunov;E.A. Kotomin;E.A. Kotomin;E. Heifets;J. Maier

  235
  Citations

• Nano-ionics in the context of lithium batteries

  P. Balaya;A.J. Bhattacharyya;J. Jamnik;Yu.F. Zhukovskii

  228
  Citations

• Basic properties of the F-type centers in halides, oxides and perovskites

  A.I. Popov;A.I. Popov;E.A. Kotomin;E.A. Kotomin;J. Maier

  226
  Citations

• Pathways for Oxygen Incorporation in Mixed Conducting Perovskites: A DFT-Based Mechanistic Analysis for (La, Sr)MnO3−δ

  Yuri A. Mastrikov;Rotraut Merkle;Eugene Heifets;Eugene A. Kotomin

  221
  Citations

• Radiation Effects in Solids

  Kurt E. Sickafus;Eugene A. Kotomin;Blas P. Uberuaga

  208
  Citations

• Modern aspects of diffusion-controlled reactions : cooperative phenomena in bimolecular processes

  E. A. Kotomin;V. Kuzovkov

  208
  Citations

• Jahn-Teller distortion around Fe 4 + in Sr ( Fe x Ti 1 − x ) O 3 − δ from x-ray absorption spectroscopy, x-ray diffraction, and vibrational spectroscopy

  M. Vračar;A. Kuzmin;R. Merkle;J. Purans

  181
  Citations

• Formation and migration of oxygen vacancies in La1−xSrxCo1−yFeyO3−δ perovskites: insight from ab initio calculations and comparison with Ba1−xSrxCo1−yFeyO3−δ

  Yuri A. Mastrikov;Yuri A. Mastrikov;Rotraut Merkle;Eugene A. Kotomin;Eugene A. Kotomin;Maija M. Kuklja

  171
  Citations

• First-principles calculations for SrTiO3(100) surface structure

  E. Heifets;R.I. Eglitis;E.A. Kotomin;E.A. Kotomin;J. Maier

  162
  Citations

• First-principles calculations of the atomic and electronic structure of F centers in the bulk and on the (001) surface of Sr Ti O 3

  J. Carrasco;F. Illas;N. Lopez;E. A. Kotomin;E. A. Kotomin

  157
  Citations

• Semi-empirical simulations of surface relaxation for perovskite titanates

  E Heifets;E.A Kotomin;E.A Kotomin;J Maier

  156
  Citations

• Atomic, electronic and magnetic structure of an oxygen interstitial in neutron-irradiated Al 2 O 3 single crystals

  V Seeman;A Lushchik;E Shablonin;G Prieditis

  154
  Citations

• Adsorption of atomic and molecular oxygen on the LaMnO3(001) surface: ab initio supercell calculations and thermodynamics

  Eugene A. Kotomin;Eugene A. Kotomin;Yuri A. Mastrikov;Yuri A. Mastrikov;Eugene Heifets;Joachim Maier

  149
  Citations

• Calculations of the effective diffusion coefficient for inhomogeneous media

  J.R. Kalnin;E.A. Kotomin;J. Maier

  145
  Citations

• Calculations of the ground and excited states of F-type centers in corundum crystals.

  A. Stashans;A. Stashans;E. Kotomin;E. Kotomin;J.-L. Calais

  145
  Citations