Jan Vícha
Jan Vícha
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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
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
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
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
Stability and aging of solubilized dialdehyde cellulose
L Münster, J Vícha, J Klofáč, M Masař, P Kucharczyk, I Kuřitka
Cellulose 24 (7), 2753-2766, 2017
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
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
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
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
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
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
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
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
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
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
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
1H‐, 13C‐, and 15N‐NMR chemical shifts for selected glucosides and ribosides of aromatic cytokinins
J Vícha, M Maloň, P Veselá, O Humpa, M Strnad, R Marek
Magnetic Resonance in Chemistry 48 (4), 318-322, 2010
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
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
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
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