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Valences of Cu in Y_(1-x)Ca_(x)Ba_(2)Cu_(3)O_(6+y)

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摘要 The valences of Cu in Y_(1-x)Ca_(x)Ba_(2)Cu_(3)O_(6+y) have been investigated by using complex chemical bond theory.The results for the valences of Cu(1)and Cu(2)in the calculation suggest that the holes introduced by calcium substitution only reside in CuO_(2) planes,and there is a competition mechanism for the hole density in CuO_(2) planes between Ca doping and oxygen depletion.These conclusions are satisfactorily in agreement with experiments.
作者 WU Zhi-jian MENG Qing-bo ZHANG Si-yuan 武志坚;孟庆波;张思远(Changchun Institute of Applied Chemistry,Chinese Academy of Sciences,Changchun 130022)
出处 《Chinese Physics Letters》 SCIE CAS CSCD 1998年第7期528-529,共2页 中国物理快报(英文版)
关键词 THEORY VALENCE satis
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