You are here

Electronic properties of RX2Al20 (R = La, Ce, Yb, Th, U; X = Ti, V, Cr and Mn) cage compounds

TitleElectronic properties of RX2Al20 (R = La, Ce, Yb, Th, U; X = Ti, V, Cr and Mn) cage compounds
Publication TypeJournal Article
Year of Publication2018
AuthorsSwatek, P, Kleinert, M, Wisniewski, P, Kaczorowski, D
JournalComputational Materials Science
Volume153
Pagination461-472
Date Published10
Type of ArticleArticle
ISBN Number0927-0256
Accession NumberWOS:000441521600056
Keywordsaluminides, band-structure, Caged compounds, cecr2al20, co, crystal-structure, Electronic band calculations, elements, Fermi surface, magnetic-properties, Materials Science, Orbital hybridization, phases, physical-properties, quantum oscillations, Rare earth intermetallics, transition-metal
Abstract

hybridization. For LaTi2Al20 and LaV2Al20 the calculated quantum oscillation frequencies are in accord with experimental reports.

DOI10.1016/j.commatsci.2018.06.047
Custom 1

Complex States

Short TitleComput. Mater. Sci.
Alternate JournalComput. Mater. Sci.