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所属单位：土木工程学院

发表刊物：zeitschrift fur anorganische und allgemeine chemie

项目来源：其他课题

关键字：Na4Cd3(CO3)4(OH)2; Carbonates; Hydrothermal synthesis; Sodium; Cadmium

摘要：The carbonate Na4Cd3(CO3)4(OH)2 was synthesized by hydrothermal methods and the crystal structure was established by singlecrystal X-ray diffraction. Na4Cd3(CO3)4(OH)2 crystallizes in the monoclinic system with space group P21/c (No.14). The structure of Na4Cd3(CO3)4(OH)2 is built-up from [Cd3(CO3)4(OH)2] layers which are separated by Na(1) and Na(2) atoms. In addition, the UV/Vis-IR diffuse reflectance spectra exhibit that it has the relatively wide bandgaps of 5.40 eV. Electronic structure and linear optical properties are studied by First-principle theoretical calculation.

论文类型：期刊论文

论文编号：6944

卷号：2015, 641

页面范围：460–463

ISSN号：0044-2313

是否译文：否

发表时间：2015-02-01