Dataset Closed Access
Kloditz, Roger; Fichter, Sebastian; Kaufmann, Sebastian; Brunner, Tobias S.; Kaden, Peter; Patzschke, Michael; Stumpf, Thorsten; Roesky, Peter W.; Schmidt, Moritz; März, Juliane
<?xml version='1.0' encoding='utf-8'?> <oai_dc:dc xmlns:dc="http://purl.org/dc/elements/1.1/" xmlns:oai_dc="http://www.openarchives.org/OAI/2.0/oai_dc/" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsi:schemaLocation="http://www.openarchives.org/OAI/2.0/oai_dc/ http://www.openarchives.org/OAI/2.0/oai_dc.xsd"> <dc:creator>Kloditz, Roger</dc:creator> <dc:creator>Fichter, Sebastian</dc:creator> <dc:creator>Kaufmann, Sebastian</dc:creator> <dc:creator>Brunner, Tobias S.</dc:creator> <dc:creator>Kaden, Peter</dc:creator> <dc:creator>Patzschke, Michael</dc:creator> <dc:creator>Stumpf, Thorsten</dc:creator> <dc:creator>Roesky, Peter W.</dc:creator> <dc:creator>Schmidt, Moritz</dc:creator> <dc:creator>März, Juliane</dc:creator> <dc:date>2020-09-17</dc:date> <dc:description>NMR spectra for the complex series in the publication together with the xyz coordinates of the optimized complexes. An example input-file for ORCA v4.1.2 for the calculation of the wavefunction used for QTAIM is presented as well.</dc:description> <dc:identifier>https://rodare.hzdr.de/record/518</dc:identifier> <dc:identifier>10.14278/rodare.518</dc:identifier> <dc:identifier>oai:rodare.hzdr.de:518</dc:identifier> <dc:language>eng</dc:language> <dc:relation>url:https://www.hzdr.de/publications/Publ-31654</dc:relation> <dc:relation>url:https://www.hzdr.de/publications/Publ-31531</dc:relation> <dc:relation>doi:10.14278/rodare.517</dc:relation> <dc:relation>url:https://rodare.hzdr.de/communities/rodare</dc:relation> <dc:rights>info:eu-repo/semantics/closedAccess</dc:rights> <dc:subject>actinides</dc:subject> <dc:subject>NMR</dc:subject> <dc:subject>DFT</dc:subject> <dc:subject>QTAIM</dc:subject> <dc:subject>NPA</dc:subject> <dc:subject>coordination chemistry</dc:subject> <dc:subject>transuranium</dc:subject> <dc:title>Series of Tetravalent Actinide Amidinates: Structure Determination and Bonding Analysis.</dc:title> <dc:type>info:eu-repo/semantics/other</dc:type> <dc:type>dataset</dc:type> </oai_dc:dc>
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