Is the chemistry of lawrencium peculiar?

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http://hdl.handle.net/10138/224395

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Xu , W & Pyykkö , P 2016 , ' Is the chemistry of lawrencium peculiar? ' , Physical Chemistry Chemical Physics , vol. 18 , no. 26 , pp. 17351-17355 . https://doi.org/10.1039/c6cp02706g

Title: Is the chemistry of lawrencium peculiar?
Author: Xu, Wen-hua; Pyykkö, Pekka
Contributor: University of Helsinki, Department of Chemistry
University of Helsinki, Department of Chemistry
Date: 2016-07-14
Language: eng
Number of pages: 5
Belongs to series: Physical Chemistry Chemical Physics
ISSN: 1463-9076
URI: http://hdl.handle.net/10138/224395
Abstract: It is explicitly verified that the atomic 7p(1) ground-state configuration of Lr originates from relativistic effects. Without relativity one has 6d(1). All three ionization potentials IP1-3 of Lr resemble those of Lu. Simple model studies on mono-and trihydrides, monocarbonyls or trichlorides suggest no major chemical differences between Lr and the lanthanides.
Subject: COUPLED-CLUSTER METHOD
VALENCE BASIS-SETS
TRANSITION ENERGIES
ATOMIC LAWRENCIUM
GROUND-STATE
LANTHANIDE
LUTETIUM
ELEMENTS
PSEUDOPOTENTIALS
PREDICTION
116 Chemical sciences
114 Physical sciences
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