List the most cited papers (> 43 times) ( ResearcherId, by March, 2015)
| 1. | S. Piskunov, E. Heifets, R.I. Eglitis, and G. Borstel. Bulk properties and electronic structure of SrTiO3, BaTiO3, PbTiO3 perovskites: an ab initio HF/DFT study. Computational Materials Science, Volume: 29, Issue: 2, Pages: 165-178, Published: FEB 2004 DOI: 10.1016/j.commatsci.2003.08.036 |
Times Cited: 260 |
| 2. | V.N. Kuzovkov, and E.A. Kotomin. Kinetics of bimolecular reactions in condensed media - critical phenomena and microscopic self-organisation. Reports on Progress in Physics, Volume: 51, Issue: 12, Pages: 1479-1523, Published: DEC 1988 DOI: 10.1088/0034-4885/51/12/001 |
Times Cited: 236 |
| 3. | E. Heifets, R.I. Eglitis, E.A. Kotomin, J. Maier, and G. Borstel. Ab initio modeling of surface structure for SrTiO3 perovskite. Physical Review B, Volume: 64, Issue: 23, Published: DEC 15 2001 DOI: 10.1103/PhysRevB.64.235417 |
Times Cited: 157 |
| 4. | E.A. Kotomin, and A.I Popov. Radiation-induced point defects in simple oxides. Nuclear Instruments & Methods in Physics Research Section B-Beam Interactions With Materials and Atoms, Volume: 141, Issue: 1-4, Pages: 1-15, Published: MAY 1998 DOI: 10.1016/S0168-583X(98)00079-2 |
Times Cited: 139 |
| 5. | S. Piskunov, E.A. Kotomin, E. Heifets, J. Maier, R.I. Eglitis, and G. Borstel. Hybrid DFT calculations of the atomic and electronic structure for ABO(3) perovskite (001) surfaces. Surface Science, Volume: 575, Issue: 1-2, Pages: 75-88, Published: JAN 20 2005 DOI: 10.1016/j.susc.2004.11.008 |
Times Cited: 104 |
| 6. | A. Stashans, E.A. Kotomin, and J.-L. Calais. Calculations of the ground and excited-states of F-tyep centers in corundum crystals Physical Review B, Volume: 49, Issue: 21, Pages: 14854-14858, Published: JUN 1 1994 DOI: 10.1103/PhysRevB.49.14854 |
Times Cited: 99 |
| 7. | V.E. Puchin, J.D. Gale, A.L. Shluger, E.A. Kotomin, J. Günster, M. Brause, and V. Kempter. Atomic and electronic structure of the corundum(0001) surface: Comparison with surface spectroscopies. Surface Science, Volume: 370, Issue: 2-3, Pages: 190-200, Published: JAN 10 1997 DOI: 10.1016/S0039-6028(96)00971-5 |
Times Cited: 91 |
| 8. | E. Heifets, E.A. Kotomin, and J. Maier. Semi-empirical simulations of surface relaxation for perovskite titanates. Surface Science, Volume: 462, Issue: 1-3, Pages: 19-35, Published: AUG 10 2000 DOI: 10.1016/S0039-6028(00)00603-8 |
Times Cited: 86 |
| 9. | E. Heifets, R.I. Eglitis, E.A. Kotomin, J. Maier, and G. Borstel. First-principles calculations for SrTiO3(100) surface structure. Surface Science, Volume: 513, Issue: 1, Pages: 211-220, Published: JUL 10 2002 DOI: 10.1016/S0039-6028(02)01730-2 |
Times Cited: 81 |
| 10. | B. Kaestner, V. Kashcheyevs, S. Amakawa, M.D. Blumenthal, L. Li, T.J.B.M. Janssen, G. Hein, K. Pierz, T. Weimann, U. Siegner, and H.W. Schumacher. Single-parameter nonadiabatic quantized charge pumping Physical Review B, Volume: 77, Issue: 15, Published: APR 2008 DOI: 10.1103/PhysRevB.77.153301 |
Times Cited: 79 |
| 11. | Yu.F. Zhukovskii, E.A. Kotomin, P.W.M. Jacobs, and A. M. Stoneham. Ab initio modeling of metal adhesion on oxide surfaces with defects. Physical Review Letters, Volume: 84, Issue: 6, Pages: 1256-1259, Published: FEB 7 2000 DOI: 10.1103/PhysRevLett.84.1256 |
Times Cited: 75 |
| 12. | J. Carrasco, F. Illas, N. Lopez, E.A. Kotomin, Yu.F. Zhukovskii, R. A. Evarestov, Yu.A. Mastrikov, S. Piskunov, and J. Maier. First-principles calculations of the atomic and electronic structure of F centers in the bulk and on the (001) surface of SrTiO3. Source: Physical Review B Volume: 73 Issue: 6 Published: FEB 2006 DOI: 10.1103/PhysRevB.73.064106 |
Times Cited: 74 |
| 13. | R.I. Eglitis, A.V. Postnikov, and G. Borstel. Semiempirical Hartree-Fock calculations for KNbO3. Physical Review B, Volume: 54, Issue: 4, Pages: 2421-2427, Published: JUL 15 1996 DOI: 10.1103/PhysRevB.54.2421 |
Times Cited: 72 |
| 14. | R.I. Eglitis, N. E. Christensen, E.A. Kotomin, A.V. Postnikov, and G. Borstel. First-principles and semiempirical calculations for F centers in KNbO3. Physical Review B, Volume: 56, Issue: 14, Pages: 8599-8604, Published: OCT 1 1997 DOI: 10.1103/PhysRevB.56.8599 |
Times Cited: 70 |
| 15. | P. Balaya, A.J. Bhattacharyya, J. Jamnik, Yu.F. Zhukovskii, E.A. Kotomin, and J. Maier. Nano-ionics in the context of lithium batteries Journal of Power Sources, Volume: 159, Issue: 1, Pages: 171-178, Published: SEP 13 2006 DOI: 10.1016/j.jpowsour.2006.04.115 |
Times Cited: 68 |
| 16. | H. Schnörer, V.N. Kuzovkov, and A. Blumen. Segregation in annihilation reactions without diffusion: Analysis of correlations. Physical Review Letters, Volume: 63, Issue: 7, Pages: 805-808, Published: AUG 14 1989 DOI: 10.1103/PhysRevLett.63.805 |
Times Cited: 67 |
| 17. | Yu.F. Zhukovskii, P. Balaya, E.A. Kotomin, and J. Maier. Evidence for interfacial-storage anomaly in nanocomposites for lithium batteries from first-principles simulations. Physical Review Letters, Volume: 96, Issue: 5, Published: FEB 10 2006 DOI: 10.1103/PhysRevLett.96.058302 |
Times Cited: 66 |
| 18. | R.I. Eglitis, A.V. Postnikov, and G. Borstel. Semiempirical Hartree-Fock calculations for pure and Li-doped KTaO3. Physical Review B, Volume: 55 Issue: 19 Pages: 12976-12981 Published: MAY 15 1997 DOI: 10.1103/PhysRevB.55.12976 |
Times Cited: 66 |
| 19. | A.L. Shluger, E.A. Kotomin, and L.N. Kantorovich. Quantum-chemical simulation of impurity-induced trapping of a hole: (Li)0 centre in MgO. Journal of Physics C-Solid State Physics, Volume: 19, Issue: 22, Pages: 4183-4199, Published: AUG 10 1986 DOI: 10.1088/0022-3719/19/22/007 |
Times Cited: 63 |
| 20. | Yu.A. Mastrikov, R. Merkle, E. Heifets, E.A. Kotomin, and J. Maier. Pathways for Oxygen Incorporation in Mixed Conducting Perovskites: A DFT-Based Mechanistic Analysis for (La, Sr)MnO(3-delta). Journal of Physical Chemistry C, Volume: 114, Issue: 7, Pages: 3017-3027, Published: FEB 25 2010 DOI: 10.1021/jp909401g |
Times Cited: 62 |
| 21. | E.A. Kotomin, A. Stashans, L.N. Kantorovich, A.I. Lifshitz, A.I. Popov, I.A. Tale, and J.-L. Calais. Calculations of the geometry and optical properties of FMg centers and dimer (F2-type) centers in corundum crystals. Physical Review B, Volume: 51, Issue: 14, Pages: 8770-8778, Published: APR 1 1995 DOI: 10.1103/PhysRevB.51.8770 |
Times Cited: 61 |
| 22. | V.S. Vikhnin, R.I. Eglitis, S.E. Kapphan, G. Borstel, and E.A. Kotomin. Polaronic-type excitons in ferroelectric oxides: Microscopic calculations and experimental manifestation. Physical Review B, Volume: 65, Issue: 10, Published: MAR 1 2002 DOI: 10.1103/PhysRevB.65.104304 |
Times Cited: 60 |
| 23. | E.A. Kotomin, and V.N. Kuzovkov. Phenomenological kinetics of Frenkel defect recombination and accumulation in ionic solids. Reports on Progress in Physics, Volume: 55, Issue: 12, Pages: 2079-2188, Published: DEC 1992 DOI: 10.1088/0034-4885/55/12/001 |
Times Cited: 60 |
| 24. | R.I. Eglitis, and D. Vanderbilt. First-principles calculations of atomic and electronic structure of SrTiO(3) (001) and (011) surfaces. Physical Review B, Volume: 77, Issue: 19, Published: MAY 2008 DOI: 10.1103/PhysRevB.77.195408 |
Times Cited: 57 |
| 25. | E.A. Kotomin, Yu.A. Mastrikov, E. Heifets, and J. Maier. Adsorption of atomic and molecular oxygen on the LaMnO3(001) surface: ab initio supercell calculations and thermodynamics. Physical Chemistry Chemical Physics, Volume: 10, Issue: 31, Pages: 4644-4649, Published: 2008 DOI: 10.1039/b804378g |
Times Cited: 56 |
| 26. | R.A. Evarestov, S. Piskunov, E.A. Kotomin, and G. Borstel. Single impurities in insulators: Ab initio study of Fe-doped SrTiO3. Physical Review B, Volume: 67, Issue: 6, Published: FEB 1 2003 DOI: 10.1103/PhysRevB.67.064101 |
Times Cited: 53 |
| 27. | P.W.M Jacobs, E.A. Kotomin, A. Stashans, E.V. Stefanovich, and I. Tale. Quantum chemical simulations of hole self-trapping in corundum. Journal of Physics-Condensed Matter, Volume: 4, Issue: 37, Pages: 7531-7544, Published: SEP 14 1992 DOI: 10.1088/0953-8984/4/37/001 |
Times Cited: 51 |
| 28. | E. Heifets, Yu.F. Zhukovskii, E.A Kotomin, and M. Causa. The adhesion nature of the Ag/MgO(100) interface: an ab initio study. Chemical Physics Letters, Volume: 283, Issue: 5-6, Pages: 395-401, Published: FEB 13 1998 DOI: 10.1016/S0009-2614(97)01393-6 |
Times Cited: 49 |
| 29. | H. Shi, R.I. Eglitis, and G. Borstel. Ab initio calculations of the CaF2 electronic structure and F centers. Physical Review B, Volume: 72, Issue: 4, Published: JUL 2005 DOI: 10.1103/PhysRevB.72.045109 |
Times Cited: 49 |
| 30. | J.R. Kalnin, E.A. Kotomin, and J. Maier. Calculations of the effective diffusion coefficient for inhomogeneous media. Journal of Physics and Chemistry of Solids Volume: 63 Issue: 3 Pages: 449-456 Published: MAR 2002 DOI: 10.1016/S0022-3697(01)00159-7 |
Times Cited: 47 |
| 31. | E.A. Kotomin, R.I. Eglitis, A.V. Postnikov, G. Borstel, and N.E. Christensen. First-principles and semiempirical calculations for bound-hole polarons in KNbO3. Physical Review B, Volume: 60, Issue: 1, Pages: 1-5, Published: JUL 1 1999 DOI: 10.1103/PhysRevB.60.1 |
Times Cited: 47 |
| 32. | E. Heifets, W.A. Goddard, III, E.A. Kotomin, R.I. Eglitis, and G. Borstel. Ab initio calculations of the SrTiO3 (110) polar surface. Physical Review B, Volume: 69, Issue: 3, Published: JAN 2004 DOI: 10.1103/PhysRevB.69.035408 |
Times Cited: 45 |
| 33. | R.I. Eglitis, and D. Vanderbilt. Ab initio calculations of BaTiO3 and PbTiO3 (001) and (011) surface structures. Physical Review B, Volume: 76, Issue: 15, Published: OCT 2007 DOI: 10.1103/PhysRevB.76.155439 |
Times Cited: 45 |
| 34. | Yu.F. Zhukovskii, E.A. Kotomin, R.A. Evarestov, and D.E. Ellis. Periodic models in quantum chemical Simulations of F Centers in crystalline metal oxides. International Journal of Quantum Chemistry, Volume: 107, Issue: 14, Pages: 2956-2985, Published: NOV 15 2007 DOI: 10.1002/qua.21483 |
Times Cited: 44 |
| 35. | Yu.A. Mastrikov, E. Heifets, E.A. Kotomin, and J. Maier. Atomic, electronic and thermodynamic properties of cubic and orthorhombic LaMnO3 surfaces. Surface Science, Volume: 603, Issue: 2, Pages: 326-335, Published: JAN 15 2009 DOI: 10.1016/j.susc.2008.11.034 |
Times Cited: 43 |
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