| Structure, solvent, and relativistic effects on the NMR chemical shifts in square-planar transition-metal complexes: assessment of DFT approaches J Vícha, J Novotný, M Straka, M Repisky, K Ruud, S Komorovsky, R Marek Physical Chemistry Chemical Physics 17 (38), 24944-24955, 2015 | 95 | 2015 |
| A relativistic DFT methodology for calculating the structures and NMR chemical shifts of octahedral platinum and iridium complexes J Vícha, M Patzschke, R Marek Physical Chemistry Chemical Physics 15 (20), 7740-7754, 2013 | 88 | 2013 |
| Stability and aging of solubilized dialdehyde cellulose L Münster, J Vícha, J Klofáč, M Masař, P Kucharczyk, I Kuřitka Cellulose 24, 2753-2766, 2017 | 80 | 2017 |
| Mechanism of spin–orbit effects on the ligand NMR chemical shift in transition-metal complexes: Linking NMR to EPR J Vícha, M Straka, ML Munzarová, R Marek Journal of chemical theory and computation 10 (4), 1489-1499, 2014 | 78 | 2014 |
| Linking the character of the metal–ligand bond to the ligand NMR shielding in transition-metal complexes: NMR contributions from spin–orbit coupling J Novotný, J Vícha, PL Bora, M Repisky, M Straka, S Komorovsky, ... Journal of Chemical Theory and Computation 13 (8), 3586-3601, 2017 | 72 | 2017 |
| Relativistic spin–orbit heavy atom on the light atom NMR chemical shifts: general trends across the periodic table explained J Vícha, S Komorovsky, M Repisky, R Marek, M Straka Journal of Chemical Theory and Computation 14 (6), 3025-3039, 2018 | 67 | 2018 |
| Understanding the electronic factors responsible for ligand spin–orbit NMR shielding in transition-metal complexes J Vícha, C Foroutan-Nejad, T Pawlak, ML Munzarová, M Straka, R Marek Journal of Chemical Theory and Computation 11 (4), 1509-1517, 2015 | 67 | 2015 |
| Unwilling U–U bonding in U 2@ C 80: cage-driven metal–metal bonds in di-uranium fullerenes C Foroutan-Nejad, J Vícha, R Marek, M Patzschke, M Straka Physical Chemistry Chemical Physics 17 (37), 24182-24192, 2015 | 57 | 2015 |
| Spectroscopic and Computational Evidence of Intramolecular AuI⋅⋅⋅H+−N Hydrogen Bonding M Straka, E Andris, J Vícha, A Růžička, J Roithová, L Rulíšek Angewandte Chemie International Edition 58 (7), 2011-2016, 2019 | 54 | 2019 |
| High-Frequency 13C and 29Si NMR Chemical Shifts in Diamagnetic Low-Valence Compounds of TlI and PbII: Decisive Role of Relativistic Effects J Vícha, R Marek, M Straka Inorganic Chemistry 55 (4), 1770-1781, 2016 | 52 | 2016 |
| Design of dialdehyde cellulose crosslinked poly (vinyl alcohol) hydrogels for transdermal drug delivery and wound dressings M Muchová, L Münster, Z Capáková, V Mikulcová, I Kuřitka, J Vícha Materials Science and Engineering: C 116, 111242, 2020 | 43 | 2020 |
| Relativity or aromaticity? A first-principles perspective of chemical shifts in osmabenzene and osmapentalene derivatives C Foroutan-Nejad, J Vícha, A Ghosh Physical Chemistry Chemical Physics 22 (19), 10863-10869, 2020 | 43 | 2020 |
| Dialdehyde cellulose crosslinked poly (vinyl alcohol) hydrogels: Influence of catalyst and crosslinker shelf life L Münster, J Vícha, J Klofáč, M Masař, A Hurajová, I Kuřitka Carbohydrate polymers 198, 181-190, 2018 | 43 | 2018 |
| Biocompatible dialdehyde cellulose/poly (vinyl alcohol) hydrogels with tunable properties L Münster, Z Capáková, M Fišera, I Kuřitka, J Vícha Carbohydrate polymers 218, 333-342, 2019 | 41 | 2019 |
| High-Frequency 1H NMR Chemical Shifts of SnII and PbII Hydrides Induced by Relativistic Effects: Quest for PbII Hydrides J Vícha, R Marek, M Straka Inorganic Chemistry 55 (20), 10302-10309, 2016 | 39 | 2016 |
| Reactive Dimerization of an N‐Heterocyclic Plumbylene: C−H Activation with PbII R Guthardt, J Oetzel, JI Schweizer, C Bruhn, R Langer, M Maurer, J Vícha, ... Angewandte Chemie International Edition 58 (5), 1387-1391, 2019 | 37 | 2019 |
| Platinum-modified adenines: unprecedented protonation behavior revealed by NMR spectroscopy and relativistic density-functional theory calculations J Vícha, G Demo, R Marek Inorganic Chemistry 51 (3), 1371-1379, 2012 | 31 | 2012 |
| Dimeric Pd (II) and Pt (II) chloride organometallics with 2-phenylpyridine and their solvolysis in dimethylsulfoxide T Pawlak, D Niedzielska, J Vícha, R Marek, L Pazderski Journal of Organometallic Chemistry 759, 58-66, 2014 | 30 | 2014 |
| Oxidized polysaccharides for anticancer-drug delivery: What is the role of structure? L Münster, M Fojtů, Z Capáková, M Muchová, L Musilová, T Vaculovič, ... Carbohydrate Polymers 257, 117562, 2021 | 24 | 2021 |
| Properties of the Only Thorium Fullerene, Th@C84, Uncovered J Kaminský, J Vícha, P Bouř, M Straka The Journal of Physical Chemistry A 121 (16), 3128-3135, 2017 | 24 | 2017 |
