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研究生: 葉哲綸
Ye, Zhu-Lun
論文名稱: 多元金屬硫族化合物的合成、結構鑑定和物理性質研究
Synthesis, Structures, and Physical Properties of Multinary Metal Chalcogenides
指導教授: 許桂芳
Hsu, Kuei-Fang
學位類別: 碩士
Master
系所名稱: 理學院 - 化學系
Department of Chemistry
論文出版年: 2013
畢業學年度: 101
語文別: 中文
論文頁數: 66
中文關鍵詞: 硫族化合物熱電
外文關鍵詞: Chalcogenides, thermoelectric
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  • 本研究以助熔長晶法,合成出兩種不同結構化合物。分別為化合物1、化合物2。
    化合物1其晶系為Orthorhombic Pnma。此結構利用CuSe3、MSe4 (M = Cu、In)形成3D立體結構骨架,並且InSe4形成四面體以共用點串接沿b軸延伸和陽離子Ba2+填充在孔道中。化合物1因為部分原子位置有Cu和In的錯排(disorder),造成解出分子式不平衡。因此,以佔有率及價數平衡原則解出分子式,並以分子式嘗試純相合成。
    化合物2,其晶系為Monoclinic P21/m。此結構利用InTe3、MTe4、MTe5 (M = Ag或In)形成3D立體結構骨架。在孔洞中,MTe4 四面體以共用點沿b軸串接和陽離子Ba2+一起填充在孔道中。化合物2因為Ag、In無法藉由X-ray分辨電子密度。由B. V. S. (Bond valence sum)輔證,部分原子位置有Ag和In的混填,由程式指令精算有問題位置皆為發散。因此,以佔有率及價數平衡原則解出分子式,並以分子式嘗試更好單晶合成條件。

    Two new compounds, 1 and 2, have been synthesized through solid state reactions with KBr flux.

    Compound 1 crystallizes in the orthorhombic Pnma, which adopts a new three-dimensional framework structure. The framework in 1 is composed of two distinct infinite chain with Ba2+ cations distributed within the tunnels.The first chain is constructed by CuSe3 triangular plane and MSe4 (M = Cu, In) tetrahedral.The second chain is constructed by InSe4 tetrahedral.

    Compound 2 crystallizes in the monoclinic P21/m, which possesses a new three-dimensional framework structure. The framework in 2 is composed of InTe3 triangular plane, MTe4 tetrahedral, and MTe5 (M = Ag or In) polyhedra with Ba2+ cations distributed within the tunnels.

    摘要 1 Abstract 2 致謝 3 目錄 4 圖目錄 6 表目錄 8 第一章 緒論 10 第二章 13 金屬硫族化合物之合成與鑑定 13 2.1 合成 13 2.2 單晶X光繞射分析 15 2.3 能量散佈光譜儀 22 2.4 粉末X光繞射分析 22 2.5 微差熱分析 23 2.6 紫外-可見-近紅外光光譜儀 24 第三章 結果與討論 25 3.1 結構描述 25 3.1.1 化合物1結構描述 26 3.1.2 化合物2結構描述 35 3.2 物理性質 43 3.2.1 化合物1性質描述 43 第四章 結論 49 第五章 參考文獻 50 第六章 附錄 52

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