| An infinite-order two-component relativistic Hamiltonian by a simple one-step transformation M Iliaš, T Saue The Journal of chemical physics 126 (6), 2007 | 655 | 2007 |
| The DIRAC code for relativistic molecular calculations T Saue, R Bast, ASP Gomes, HJA Jensen, L Visscher, IA Aucar, ... The Journal of chemical physics 152 (20), 2020 | 390 | 2020 |
| The molecular mean-field approach for correlated relativistic calculations J Sikkema, L Visscher, T Saue, M Iliaš The Journal of chemical physics 131 (12), 2009 | 281 | 2009 |
| Theoretical study of PbO and the PbO anion M Iliaš, HJA Jensen, V Kellö, BO Roos, M Urban Chemical physics letters 408 (4-6), 210-215, 2005 | 107 | 2005 |
| Relativistic effects in atomic and molecular properties M Iliaš, V Kelloe, M Urban Acta Physica Slovaca. Reviews and Tutorials 60 (3), 259-391, 2010 | 91 | 2010 |
| Analysis of parity violation in chiral molecules R Bast, A Koers, ASP Gomes, M Iliaš, L Visscher, P Schwerdtfeger, ... Physical Chemistry Chemical Physics 13 (3), 864-876, 2011 | 74 | 2011 |
| Gauge origin independent calculations of nuclear magnetic shieldings in relativistic four-component theory M Iliaš, T Saue, T Enevoldsen, HJA Jensen The Journal of chemical physics 131 (12), 124119, 2009 | 73 | 2009 |
| Inclusion of mean-field spin–orbit effects based on all-electron two-component spinors: Pilot calculations on atomic and molecular properties M Iliaš, V Kellö, L Visscher, B Schimmelpfennig The Journal of Chemical Physics 115 (21), 9667-9674, 2001 | 65 | 2001 |
| Comparative study of electron correlation and relativistic effects in CuF, AgF, and AuF M Iliaš, P Furdík, M Urban The Journal of Physical Chemistry A 102 (27), 5263-5268, 1998 | 62 | 1998 |
| Relativistic effects in the intermolecular interaction-induced nuclear magnetic resonance parameters of xenon dimer M Hanni, P Lantto, M Iliaš, HJA Jensen, J Vaara The Journal of chemical physics 127 (16), 164313, 2007 | 54 | 2007 |
| Relativistic study of nuclear-anapole-moment effects in diatomic molecules A Borschevsky, M Iliaš, VA Dzuba, VV Flambaum, P Schwerdtfeger Physical Review A—Atomic, Molecular, and Optical Physics 88 (2), 022125, 2013 | 53 | 2013 |
| Mechanochemical Conversion of Aromatic Amines to Aryl Trifluoromethyl Ethers M Jakubczyk, S Mkrtchyan, M Shkoor, S Lanka, Š Budzák, M Iliaš, ... Journal of the American Chemical SocietyJournal of the American Chemical …, 2022 | 50 | 2022 |
| Systematic study and uncertainty evaluation of P, T-odd molecular enhancement factors in BaF PAB Haase, DJ Doeglas, A Boeschoten, E Eliav, M Iliaš, P Aggarwal, ... The Journal of chemical physics 155 (3), 034309, 2021 | 45 | 2021 |
| Hyperfine structure constants on the relativistic coupled cluster level with associated uncertainties PAB Haase, E Eliav, M Iliaš, A Borschevsky The Journal of Physical Chemistry A 124 (16), 3157-3169, 2020 | 41 | 2020 |
| Nuclear spin-dependent parity-violating effects in light polyatomic molecules Y Hao, P Navrátil, EB Norrgard, M Iliaš, E Eliav, RGE Timmermans, ... Physical Review A 102 (5), 052828, 2020 | 38 | 2020 |
| Gauge origin independent calculations of molecular magnetisabilities in relativistic four-component theory M Iliaš, HJA Jensen, R Bast, T Saue Molecular Physics 111 (9-11), 1373-1381, 2013 | 36 | 2013 |
| Nuclear anapole moment interaction in BaF from relativistic coupled-cluster theory Y Hao, M Iliaš, E Eliav, P Schwerdtfeger, VV Flambaum, A Borschevsky Physical Review A 98 (3), 032510, 2018 | 33 | 2018 |
| Hexacarbonyls of Mo, W, and Sg: Metal–CO Bonding Revisited M Iliaš, V Pershina Inorganic chemistry 56 (3), 1638-1645, 2017 | 26 | 2017 |
| Nuclear-spin-dependent parity violation in diatomic molecular ions A Borschevsky, M Iliaš, VA Dzuba, K Beloy, VV Flambaum, ... Physical Review A—Atomic, Molecular, and Optical Physics 86 (5), 050501, 2012 | 24 | 2012 |
| -odd interaction constant from relativistic ab initio calculations of diatomic molecules A Borschevsky, M Iliaš, VA Dzuba, K Beloy, VV Flambaum, ... Physical Review A—Atomic, Molecular, and Optical Physics 85 (5), 052509, 2012 | 22 | 2012 |
A. BorschevskyThe van Swinderen Institute, University of GroningenVerified email at rug.nl
