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Published in 2018 at "Computational Materials Science"
DOI: 10.1016/j.commatsci.2018.06.047
Abstract: Abstract Non-spin-polarized electronic structures and Fermi surface properties of RX 2 Al20 (R = La, Ce, Yb, Th, U; X = Ti, V, Cr, Mn) intermetallic compounds were calculated using the full potential all-electron local orbital (FPLO)…
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Keywords:
electronic properties;
cage compounds;
rx2al20 cage;
properties rx2al20 ... See more keywords