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中国物理学会期刊

钙钛矿型晶体A(B1/31B2/32)O3中的有序-无序相变

CSTR: 32037.14.aps.39.325

A STUDY ON THE ORDER-DISORDER TRANSITION IN A+2(B1/31B2/32)O3 PEROVSKITES

CSTR: 32037.14.aps.39.325
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  • 本文利用原子集团变分方法,讨论了A+2(B1/3+2B2/3+5)O3系统中有序-无序相变,指出在此系统中相互作用能参数对形成(B2/3+2B1/3+5)1/2:B1/2+5=1:1的混合型有序畴和B1/3 

    By use of cluster variation method, a study of orderdisorder transition in A+2(B1/31B2/32)O3 system was carried out. Theoretical calculation indicated that the interaction energy parameter J had a great influnce on formation of both, the (B2/31B1/32)1/2 :B1/22 =1:1 mixed ordered domain and B1/31:B2/32= 1:2 domain, and predicted that it was more difficult to form the B1/31:B2/32= 1:2 full ordered domain relatively to the (B2/31B1/32)1/2B1/22 = 1:1 mixed ordered domain.

     

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