Phase diagram and physical properties of iridium tetraboride from first principles
2016 ◽
Vol 18
(18)
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pp. 12569-12575
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Keyword(s):
Using both the swarm-intelligence-based CALYPSO method and the multi-algorithm-collaborative (MAC) algorithm for crystal structure prediction, three unexpected new phases (P63/mmc, C2/m and Cmca) of IrB4 are predicted.
2015 ◽
Vol 45
(2)
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pp. 999-1010
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Keyword(s):
2013 ◽
Vol 577
◽
pp. 463-468
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Keyword(s):
Keyword(s):