Electronic structure of francium

This article presents the first calculations of the electronic structure of francium for the bcc, fcc, and hcp structures, using the linearized augmented plane wave (LAPW) method. Both the local density approximation (LDA) and generalized gradient approximation (GGA) were used to calculate the elect...

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Veröffentlicht in:	International journal of quantum chemistry 2013-09, Vol.113 (17), p.2070-2077
Hauptverfasser:	Koufos, Alexander P., Papaconstantopoulos, Dimitrios A.
Format:	Artikel
Sprache:	eng
Schlagworte:	Chemistry density functional theory electronic structure francium Physical chemistry Quantum physics superconductivity
Online-Zugang:	Volltext
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