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Finite nucleus effects, relativistic effects and picture change error in the IOTC/DKH2 contact spin densities of Cu, Ag, Au atoms Cover

Finite nucleus effects, relativistic effects and picture change error in the IOTC/DKH2 contact spin densities of Cu, Ag, Au atoms

Acta Chimica Slovaca
Volume 7 (2014): Issue 2 (October 2014)
By: Michal Malček,  Lukáš Bučinský and  Stanislav Biskupič  
Open Access
|Dec 2014
DOI: https://doi.org/10.2478/acs-2014-0012 | Journal eISSN: 1339-3065 | Journal ISSN: 1337-978X
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Language: English
Page range: 65 - 72
Published on: Dec 20, 2014
Published by: Slovak University of Technology in Bratislava
In partnership with: Paradigm Publishing Services
Publication frequency: 2 issues per year
Keywords:
contact spin density,
nucleus model,
PCE correction,
picture change error
Related subjects:
Chemistry,
Chemistry, other

© 2014 Michal Malček, Lukáš Bučinský, Stanislav Biskupič, published by Slovak University of Technology in Bratislava
This work is licensed under the Creative Commons Attribution-NonCommercial-NoDerivatives 3.0 License.

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