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Angewandte Chemie (International Ed. in English)
|
March 12, 2014
Aerobic damage to [FeFe]-hydrogenases: activation barriers for the chemical attachment of O2
Adam Kubas, David De Sancho, Robert B Best, et al.
Physical Chemistry Chemical Physics : PCCP
|
June 11, 2020
Interaction of light with a non-covalent zinc porphyrin-graphene oxide nanohybrid
Ewelina Gacka, Gotard Burdzinski, Bronisław Marciniak, et al.
Journal of Chemical Theory and Computation
|
June 28, 2018
Restricted Open-Shell Configuration Interaction Singles Study on M- and L-edge X-ray Absorption Spectroscopy of Solid Chemical Systems
Adam Kubas, Max Verkamp, Josh Vura-Weis, et al.
Chemical Science
|
October 10, 2017
A combined experimental and theoretical spectroscopic protocol for determination of the structure of heterogeneous catalysts: developing the information content of the resonance Raman spectra of M1 MoVO <sub></sub>
Adam Kubas, Johannes Noak, Annette Trunschke, et al.
The Journal of Physical Chemistry. A
|
August 31, 2011
Charge density analysis of 2-methyl-4-nitro-1-phenyl-1H-imidazole-5-carbonitrile: an experimental and theoretical study of C≡N···C≡N interactions
Agnieszka Paul, Maciej Kubicki, Adam Kubas, et al.
Physical Chemistry Chemical Physics : PCCP
|
January 10, 2015
Electronic couplings for molecular charge transfer: benchmarking CDFT, FODFT and FODFTB against high-level ab initio calculations. II
Adam Kubas, Fruzsina Gajdos, Alexander Heck, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
October 4, 2021
NMR Crystallography Enhanced by Quantum Chemical Calculations and Liquid State NMR Spectroscopy for the Investigation of Se-NHC Adducts*
Adam Mames, Mariusz Pietrzak, Piotr Bernatowicz, et al.
The Journal of Chemical Physics
|
April 3, 2015
Erratum: "Electronic couplings for molecular charge transfer: Benchmarking CDFT, FODFT, and FODFTB against high-level ab initio calculations" [J. Chem. Phys. 140, 104105 (2014)]
Adam Kubas, Felix Hoffmann, Alexander Heck, et al.
The Journal of Physical Chemistry Letters
|
October 4, 2016
Surface Adsorption Energetics Studied with "Gold Standard" Wave-Function-Based Ab Initio Methods: Small-Molecule Binding to TiO<sub>2</sub>(110)
Adam Kubas, Daniel Berger, Harald Oberhofer, et al.
Organic & Biomolecular Chemistry
|
August 29, 2019
Z-isomerization of retinoids through combination of monochromatic photoisomerization and metal catalysis
Shirin Kahremany, Christopher Lane Sander, Gregory P Tochtrop, et al.
Page
of 6
Search research articles
Search
Showing results (11-20 of 54) with videos related to
Sort By:
Page
of 6
Angewandte Chemie (International Ed. in English)
|
March 12, 2014
Aerobic damage to [FeFe]-hydrogenases: activation barriers for the chemical attachment of O2
Adam Kubas, David De Sancho, Robert B Best, et al.
Physical Chemistry Chemical Physics : PCCP
|
June 11, 2020
Interaction of light with a non-covalent zinc porphyrin-graphene oxide nanohybrid
Ewelina Gacka, Gotard Burdzinski, Bronisław Marciniak, et al.
Journal of Chemical Theory and Computation
|
June 28, 2018
Restricted Open-Shell Configuration Interaction Singles Study on M- and L-edge X-ray Absorption Spectroscopy of Solid Chemical Systems
Adam Kubas, Max Verkamp, Josh Vura-Weis, et al.
Chemical Science
|
October 10, 2017
A combined experimental and theoretical spectroscopic protocol for determination of the structure of heterogeneous catalysts: developing the information content of the resonance Raman spectra of M1 MoVO <sub></sub>
Adam Kubas, Johannes Noak, Annette Trunschke, et al.
The Journal of Physical Chemistry. A
|
August 31, 2011
Charge density analysis of 2-methyl-4-nitro-1-phenyl-1H-imidazole-5-carbonitrile: an experimental and theoretical study of C≡N···C≡N interactions
Agnieszka Paul, Maciej Kubicki, Adam Kubas, et al.
Physical Chemistry Chemical Physics : PCCP
|
January 10, 2015
Electronic couplings for molecular charge transfer: benchmarking CDFT, FODFT and FODFTB against high-level ab initio calculations. II
Adam Kubas, Fruzsina Gajdos, Alexander Heck, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
October 4, 2021
NMR Crystallography Enhanced by Quantum Chemical Calculations and Liquid State NMR Spectroscopy for the Investigation of Se-NHC Adducts*
Adam Mames, Mariusz Pietrzak, Piotr Bernatowicz, et al.
The Journal of Chemical Physics
|
April 3, 2015
Erratum: "Electronic couplings for molecular charge transfer: Benchmarking CDFT, FODFT, and FODFTB against high-level ab initio calculations" [J. Chem. Phys. 140, 104105 (2014)]
Adam Kubas, Felix Hoffmann, Alexander Heck, et al.
The Journal of Physical Chemistry Letters
|
October 4, 2016
Surface Adsorption Energetics Studied with "Gold Standard" Wave-Function-Based Ab Initio Methods: Small-Molecule Binding to TiO<sub>2</sub>(110)
Adam Kubas, Daniel Berger, Harald Oberhofer, et al.
Organic & Biomolecular Chemistry
|
August 29, 2019
Z-isomerization of retinoids through combination of monochromatic photoisomerization and metal catalysis
Shirin Kahremany, Christopher Lane Sander, Gregory P Tochtrop, et al.
Page
of 6