| Density-functional theory calculations of aqueous redox potentials of fourth-period transition metals M Uudsemaa, T Tamm The Journal of Physical Chemistry A 107 (46), 9997-10003, 2003 | 172 | 2003 |
| Theory of the d10−d10 Closed-Shell Attraction. 4. X(AuL)nm+ Centered Systems P Pyykkoe, T Tamm Organometallics 17 (22), 4842-4852, 1998 | 103 | 1998 |
| About the mutagenicity of chlorine-substituted furanones and halopropenals. A QSAR study using molecular orbital indices K Tuppurainen, S Lötjönen, R Laatikainen, T Vartiainen, U Maran, ... Mutation Research/Fundamental and Molecular Mechanisms of Mutagenesis 247 (1 …, 1991 | 89 | 1991 |
| MO calculations applicable to condensed phases: the combination of self-consistent reaction field theory with semi-empirical quantum-chemical methods MM Karelson, T Tamm, AR Katritzky, SJ Cato, MC Zerner Tetrahedron Computer Methodology 2 (5), 295-304, 1989 | 85 | 1989 |
| ZINDO-MN version 1.2 MC Zerner, JE Ridley, AD Bacon, WD Edwards, JD Head, J McKelvey, ... Quantum Theory Project and University of Minnesota: Gainesville, FL, and …, 2005 | 84* | 2005 |
| Multicavity reaction field method for the solvent effect description in flexible molecular systems M Karelson, T Tamm, MC Zerner The Journal of Physical Chemistry 97 (46), 11901-11907, 1993 | 83 | 1993 |
| Computational study of cation substitutions in apatites T Tamm, M Peld Journal of Solid State Chemistry 179 (5), 1581-1587, 2006 | 67 | 2006 |
| Enantioselective organocatalytic Michael addition of aldehydes to β-nitrostyrenes M Laars, K Ausmees, M Uudsemaa, T Tamm, T Kanger, M Lopp The Journal of Organic Chemistry 74 (10), 3772-3775, 2009 | 66 | 2009 |
| Template-controlled synthesis of chiral cyclohexylhemicucurbit [8] uril E Prigorchenko, M Öeren, S Kaabel, M Fomitšenko, I Reile, I Järving, ... Chemical communications 51 (54), 10921-10924, 2015 | 57* | 2015 |
| Reaction field effects on the electronic structure of carbon radical and ionic centers M Karelson, T Tamm, AR Katritzky, M Szafran, MC Zerner International journal of quantum chemistry 37 (1), 1-13, 1990 | 57 | 1990 |
| Calculations on indium and thallium cyclopentadienyls. Metal–metal interactions and possible new species P Pyykkö, M Straka, T Tamm Physical Chemistry Chemical Physics 1 (15), 3441-3444, 1999 | 51 | 1999 |
| Theoretical Investigation of a Parallel Catalytic Cycle in CO2 Hydrogenation by (PNP)IrH3 I Osadchuk, T Tamm, MSG Ahlquist Organometallics 34 (20), 4932-4940, 2015 | 45 | 2015 |
| Calculation of hydration enthalpies of aqueous transition metal cations using two coordination shells and central ion substitution M Uudsemaa, T Tamm Chemical physics letters 400 (1-3), 54-58, 2004 | 39 | 2004 |
| Calculated Structures of MO22+, MN2, and MP2 (M= Mo, W) P Pyykkö, T Tamm The Journal of Physical Chemistry A 101 (43), 8107-8114, 1997 | 31 | 1997 |
| Identification and structural characterization of the predominant species present in alkaline hydroxyberyllate solutions H Schmidbaur, M Schmidt, A Schier, J Riede, T Tamm, P Pyykkö Journal of the American Chemical Society 120 (12), 2967-2968, 1998 | 30 | 1998 |
| Computational and ion mobility MS study of (all-S)-cyclohexylhemicucurbit [6] uril structure and complexes M Öeren, E Shmatova, T Tamm, R Aav Physical Chemistry Chemical Physics 16 (36), 19198-19205, 2014 | 27 | 2014 |
| Reduced State of Iridium PCP Pincer Complexes in Electrochemical CO2 Hydrogenation I Osadchuk, T Tamm, MSG Ahlquist ACS Catalysis 6 (6), 3834-3839, 2016 | 26 | 2016 |
| Multicavity SCRF calculation of ion hydration energies GHF Diercksen, M Karelson, T Tamm, MC Zerner International Journal of Quantum Chemistry 52 (S28), 339-348, 1994 | 25 | 1994 |
| Calculations of hydrated titanium ion complexes: structure and influence of the first two coordination spheres M Uudsemaa, T Tamm Chemical physics letters 342 (5-6), 667-672, 2001 | 24 | 2001 |
| pKa calculation for monoprotonated bipiperidine, bimorpholine and their derivatives in H2O and MeCN M Uudsemaa, T Kanger, M Lopp, T Tamm Chemical Physics Letters 485 (1-3), 83-86, 2010 | 22 | 2010 |
Mati KarelsonProfessor of Molecular Technology, University of TartuVerified email at ut.ee
