国际晶体学联合会
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作者:X. F. Dai , X. M. Zhang ...
来源:[J].IUCrJ, 2019, Vol.6 (Pt 4), pp.552-557IUCr
摘要:A Cr 3 Al compound with a DO 3 structure has previously been predicted to be nearly half metal and a promising spintronics material; however, its synthesis has not been reported. Here, a Cr 3 Al compound with a DO 3 structure is successfully prepared in thin-film form by the...
作者:X. F. Dai , L. Y. Wang ...
来源:[J].IUCrJ, 2019, Vol.6 (Pt 4), pp.688-694IUCr
摘要:CsCl-type materials have many outstanding characteristics, i.e. simple in structure, ease of synthesis and good stability at room temperature, thus are an excellent choice for designing functional materials. Using high-throughput first-principles calculations, a large number of t...
作者:X. F. Dai , X. M. Zhang ...
来源:[J].IUCrJ, 2020, Vol.7 (Pt 1), pp.113-120IUCr
摘要:A series of Co 2−x Ru x MnSi (x = 0, 0.25, 0.5, 0.75, 1) Heusler compounds were successfully synthesized. The heat-treatment conditions were crucial to make the materials form a single phase with a Heusler structure. With increasing Ru content, the half-metallic gap, lattice...

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