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Magnetic Resonance in Chemistry : MRC
|
May 12, 2009
Complete basis set prediction of methanol isotropic nuclear magnetic shieldings and indirect nuclear spin-spin coupling constants (SSCC) using polarization-consistent and XZP basis sets and B3LYP and BHandH density functionals
Teobald Kupka
Magnetic Resonance in Chemistry : MRC
|
August 15, 2009
H2O, H2, HF, F2 and F2O nuclear magnetic shielding constants and indirect nuclear spin-spin coupling constants (SSCCs) in the BHandH/pcJ-n and BHandH/XZP Kohn-Sham limits
Teobald Kupka
Magnetic Resonance in Chemistry : MRC
|
December 17, 2008
Prediction of water's isotropic nuclear shieldings and indirect nuclear spin-spin coupling constants (SSCCs) using correlation-consistent and polarization-consistent basis sets in the Kohn-Sham basis set limit
Teobald Kupka
Magnetic Resonance in Chemistry : MRC
|
July 10, 2008
Complete basis set B3LYP NMR calculations of CDCl3 solvent's water fine spectral details
Teobald Kupka
The Journal of Physical Chemistry. A
|
February 21, 2007
Polarization-consistent versus correlation-consistent basis sets in predicting molecular and spectroscopic properties
Teobald Kupka, Carmay Lim
Magnetic Resonance in Chemistry : MRC
|
September 18, 2014
3He NMR studies on helium-pyrrole, helium-indole, and helium-carbazole systems: a new tool for following chemistry of heterocyclic compounds
Klaudia Radula-Janik, Teobald Kupka
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
August 28, 2015
Theoretical and experimental NMR studies on muscimol from fly agaric mushroom (Amanita muscaria)
Teobald Kupka, Piotr P Wieczorek
Molecules (Basel, Switzerland)
|
April 26, 2025
New Insights into Nuclear Magnetic Resonance (NMR) Spectroscopy
Ioannis P Gerothanassis, Teobald Kupka
The Journal of Chemical Physics
|
April 17, 2014
Theoretical prediction of nuclear magnetic shieldings and indirect spin-spin coupling constants in 1,1-, cis-, and trans-1,2-difluoroethylenes
Farhod Nozirov, Teobald Kupka, Michał Stachów
Journal of Molecular Graphics & Modelling
|
July 8, 2014
Theoretical prediction of structural, vibrational and NMR parameters of plastic optical fiber (POF) material precursors. Cis and trans perhydro- and perfluoro-2-methylene-4,5-dimethyl-1,3-dioxolanes
Farhod Nozirov, Teobald Kupka, Michał Stachów
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Search research articles
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Showing results (1-10 of 61) with videos related to
Sort By:
Page
of 7
Magnetic Resonance in Chemistry : MRC
|
May 12, 2009
Complete basis set prediction of methanol isotropic nuclear magnetic shieldings and indirect nuclear spin-spin coupling constants (SSCC) using polarization-consistent and XZP basis sets and B3LYP and BHandH density functionals
Teobald Kupka
Magnetic Resonance in Chemistry : MRC
|
August 15, 2009
H2O, H2, HF, F2 and F2O nuclear magnetic shielding constants and indirect nuclear spin-spin coupling constants (SSCCs) in the BHandH/pcJ-n and BHandH/XZP Kohn-Sham limits
Teobald Kupka
Magnetic Resonance in Chemistry : MRC
|
December 17, 2008
Prediction of water's isotropic nuclear shieldings and indirect nuclear spin-spin coupling constants (SSCCs) using correlation-consistent and polarization-consistent basis sets in the Kohn-Sham basis set limit
Teobald Kupka
Magnetic Resonance in Chemistry : MRC
|
July 10, 2008
Complete basis set B3LYP NMR calculations of CDCl3 solvent's water fine spectral details
Teobald Kupka
The Journal of Physical Chemistry. A
|
February 21, 2007
Polarization-consistent versus correlation-consistent basis sets in predicting molecular and spectroscopic properties
Teobald Kupka, Carmay Lim
Magnetic Resonance in Chemistry : MRC
|
September 18, 2014
3He NMR studies on helium-pyrrole, helium-indole, and helium-carbazole systems: a new tool for following chemistry of heterocyclic compounds
Klaudia Radula-Janik, Teobald Kupka
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
August 28, 2015
Theoretical and experimental NMR studies on muscimol from fly agaric mushroom (Amanita muscaria)
Teobald Kupka, Piotr P Wieczorek
Molecules (Basel, Switzerland)
|
April 26, 2025
New Insights into Nuclear Magnetic Resonance (NMR) Spectroscopy
Ioannis P Gerothanassis, Teobald Kupka
The Journal of Chemical Physics
|
April 17, 2014
Theoretical prediction of nuclear magnetic shieldings and indirect spin-spin coupling constants in 1,1-, cis-, and trans-1,2-difluoroethylenes
Farhod Nozirov, Teobald Kupka, Michał Stachów
Journal of Molecular Graphics & Modelling
|
July 8, 2014
Theoretical prediction of structural, vibrational and NMR parameters of plastic optical fiber (POF) material precursors. Cis and trans perhydro- and perfluoro-2-methylene-4,5-dimethyl-1,3-dioxolanes
Farhod Nozirov, Teobald Kupka, Michał Stachów
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of 7