Publication
Title
Electrostatic potentials at the nucleus for isoelectronic series of light atomic ions using the QMC method in relation to DFT
Author
Abstract
The electrostatic potential at the nucleus is here calculated using the quantum Monte Carlo method. Both variational and diffusion-type data are presented for four different isoelectronic series of atomic ions, namely He, Li, Be and B. These results are then utilized to evaluate the ground-state energies of such atomic ions.
Language
English
Source (journal)
Journal of mathematical chemistry. - Basel
Publication
Basel : 2015
ISSN
0259-9791
Volume/pages
53:8(2015), p. 1725-1732
ISI
000359408800006
Full text (Publisher's DOI)
Full text (publisher's version - intranet only)
UAntwerpen
Faculty/Department
Research group
Publication type
Subject
Affiliation
Publications with a UAntwerp address
External links
Web of Science
Record
Identification
Creation 05.10.2015
Last edited 19.10.2017
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