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Journal of Computational Chemistry|June 16, 2026
An Energy-Corrected Fast Post-SCF Local-Hybrid Scheme for Highly Accurate Energy Differences of Large Main-Group SystemsArtur Wodyński, Martin KauppJournal of Chemical Theory and Computation|December 14, 2019
Noncollinear Relativistic Two-Component X2C Calculations of Hyperfine Couplings Using Local Hybrid Functionals. Importance of the High-Density Coordinate Scaling LimitArtur Wodyński, Martin KauppThe Journal of Chemical Physics|January 21, 2014
The influence of a presence of a heavy atom on the spin-spin coupling constants between two light nuclei in organometallic compounds and halogen derivativesArtur Wodyński, Magdalena PeculJournal of Chemical Theory and Computation|September 28, 2022
Local Hybrid Functional Applicable to Weakly and Strongly Correlated SystemsArtur Wodyński, Martin KauppJournal of Chemical Theory and Computation|January 30, 2018
Noncollinear Two-Component Quasirelativistic Description of Spin Interactions in Exchange-Coupled Systems. Mapping Generalized Broken-Symmetry States to Effective Spin HamiltoniansArtur Wodyński, Martin KauppJournal of Computational Chemistry|January 24, 2026
Local-Hybrid Functional With a Composite Local Mixing Function Built From a Neural Network and a Strong-Correlation ModelArtur Wodyński, Martin KauppJournal of Chemical Theory and Computation|July 18, 2025
"Beyond-Zero-Sum" Range-Separated Local Hybrid Functional with Improved Dynamical CorrelationArtur Wodyński, Martin KauppThe Journal of Physical Chemistry. A|June 12, 2019
Density Functional Calculations of Electron Paramagnetic Resonance g- and Hyperfine-Coupling Tensors Using the Exact Two-Component (X2C) Transformation and Efficient Approximations to the Two-Electron Spin-Orbit TermsArtur Wodyński, Martin KauppDalton Transactions (Cambridge, England : 2003)|December 4, 2014
The selectivity of diglycolamide (TODGA) and bis-triazine-bipyridine (BTBP) ligands in actinide/lanthanide complexation and solvent extraction separation - a theoretical approachJerzy Narbutt, Artur Wodyński, Magdalena PeculThe Journal of Physical Chemistry. A|December 31, 2025
Data-Driven Learning of Optimal Position-Dependent Exact-Exchange Energy Density Mixing for Improved Density FunctionalsMartin Kaupp, Nóra Kovács, Artur WodyńskiPageof 4