Calculated lattice structure, stability and properties of the series Bi2X2CuO6 (X=Ca, Sr, Ba), Bi2X2YCu2O8 (X=Ca, Sr, Ba; Y=Mg, Ca, Sr, Ba) and Bi2X2Y2Cu3O10 (X=Ca, Sr, Ba; Y=Ba, Sr, Ca, Mg)
Calculated lattice structure, stability and properties of the series Bi2X2CuO6 (X=Ca, Sr, Ba), Bi2X2YCu2O8 (X=Ca, Sr, Ba; Y=Mg, Ca, Sr, Ba) and Bi2X2Y2Cu3O10 (X=Ca, Sr, Ba; Y=Ba, Sr, Ca, Mg)
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Bi2X2CuO6 (X=Ca, Sr, Ba)、Bi2X2YCu2O8 (X=Ca, Sr, Ba; Y=Mg, Ca, Sr, Ba) 和 Bi2X2Y2Cu3O10 (X=Ca, Sr, Ba) 系列的计算晶格结构、稳定性和性能
DOI：
10.1088/0953-2048/1/6/016
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发表时间：
1989
影响因子：
3.6
通讯作者：
W. Mackrodt
中科院分区：
文献类型：
--
作者：
W. Mackrodt
原子晶格计算报告了 Bi2X2CuO6 (X=Ca, Sr, Ba)、Bi2X2YCu2O8 (X=Ca, Sr, Ba; Y=Mg, Ca, Sr, Ba) 和 Bi2X2Y2Cu3O10 (X=Ca, Sr, Ba; Y=Ba, Sr, Ca, Mg) 系列的结构、稳定性、声子态密度和弹性性质。与 Bi2Sr2CuO6、Bi2Sr2CaCu2O8 和 Bi2Sr2Ca2Cu3O10 进行比较，它们接近最近发现的高温相。
Atomistic lattice calculations are reported of the structure, stability, phonon density of states and elastic properties of the series Bi2X2CuO6 (X=Ca, Sr, Ba), Bi2X2YCu2O8 (X=Ca, Sr, Ba; Y=Mg, Ca, Sr, Ba) and Bi2X2Y2Cu3O10 (X=Ca, Sr, Ba; Y=Ba, Sr, Ca, Mg). Comparisons are made with Bi2Sr2CuO6, Bi2Sr2CaCu2O8 and Bi2Sr2Ca2Cu3O10, which are close to recently discovered high-Tc phases.