K
Karin Eichkorn
Researcher at Karlsruhe Institute of Technology
Publications - 9
Citations - 7236
Karin Eichkorn is an academic researcher from Karlsruhe Institute of Technology. The author has contributed to research in topics: Coulomb & Hydrogen bond. The author has an hindex of 6, co-authored 9 publications receiving 6793 citations.
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Auxiliary basis sets for main row atoms and transition metals and their use to approximate Coulomb potentials
TL;DR: In this paper, the auxilliary basis sets for the atoms H to At were optimized for an efficient treatment of molecular electronic Coulomb interactions for molecules with up to 300 atoms and 2500 basis functions.
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Auxiliary basis sets to approximate Coulomb potentials
TL;DR: In this article, an approximate treatment of Coulomb operators based on the expansion of molecular electron densities in atom-centered auxiliary basis sets is proposed. But this approach is not suitable for all atoms and cannot be applied to all atoms.
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Auxiliary basis sets to approximate Coulomb potentials (Chem. Phys. Letters 240 (1995) 283-290)
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Cadmium selenide semiconductor nanocrystals: a theoretical study
Karin Eichkorn,Reinhart Ahlrichs +1 more
TL;DR: In this article, a series of known ligand-stabilized clusters of CdSe and compute structure, electronic excitations and electron affinities with a density functional theory approach.
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Aqueous Ethylenediamine Dihydroxo Palladium(II): A Coordinating Agent for Low‐ and High‐Molecular Weight Carbohydrates
Reinhart Ahlrichs,Matthias Ballauff,Karin Eichkorn,Otto Hanemann,Gerhard Kettenbach,Peter Klüfers +5 more
TL;DR: In this paper, three crystalline palladium(ii) complexes have been isolated and characterized with anhydroerythritol (AnEryt), 1,6-anhydro-b-d-glucose (1,6AnGlc, levoglucosan), and sucrose (Suc) as the polyol components.