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Exploration and Optimization of Tel
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Abstract Thermoelectric materials a
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Acknowledgements To begin, I would
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Table of Contents List of Figures..
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9.3.1. Heating, XRD, and Structural
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List of Figures Figure 1.1 (a) Pelt
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Figure 9.2 Selected DOS calculation
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List of Equations Equation 1.1 Dime
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Table B.1 Atomic positions, isotrop
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Section I: Fundamentals Background
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Opposing the Peltier Effect is the
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Hence it follows that a good thermo
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a b ∗ Equation 1.4 (a) Ele
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Historically, thermoelectric materi
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1.3.2. Advantages and Disadvantages
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common stoichiometry studied with c
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Figure 1.8 (a) Ge Quantum Dots [74]
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Chapter 2. Background of the Solid
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2.2. Defects, Non‐Stoichiometry a
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electric field draws electrons towa
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∑ known as a Bloch function, w
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orbital Hamilton population [96] i
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2.5.1. Doping and Substitution: Tun
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The major problem with exclusively
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Chapter 3. Synthesis Techniques All
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Since reactions are driven by both
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Table 3.1 Commonly used fluxes. [12
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The procedure is carried‐out on a
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Chapter 4. X‐Ray Diffraction Anal
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The closely related electron densit
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- Page 65 and 66: 4.3.1. Rietveld Method In 1967, Hug
- Page 67 and 68: Chapter 5. Physical Property Measur
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- Page 71 and 72: a p b 0.1388 53 c Equati
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- Page 75 and 76: Figure 5.6 Home‐made electrical c
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- Page 79 and 80: The EDX measurement system utilized
- Page 81 and 82: 2 4 ext Equation 6.2 Ma
- Page 83 and 84: Section III - Layered Bi2Te3 Compou
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- Page 87 and 88: Pb‐based compound (~‐60 V∙K
- Page 89 and 90: also differ in 2 there, while the r
- Page 91 and 92: Table 7.2 LeBail data for phase‐p
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- Page 95 and 96: Upon examination of the power facto
- Page 97 and 98: Sn2Bi2Te5 was eventually found pure
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- Page 105 and 106: Figure 8.3 DOS calculation comparis
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- Page 109 and 110: 8.3.3. Physical Property Measuremen
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- Page 115 and 116: 8.4. Conclusions and Future Work A
- Page 117 and 118: in Chapter 3 (except Arc Melting) w
- Page 119 and 120: Table 9.2 LeBail refinements on var
- Page 121 and 122: 9.2.3.1. Doping Trials: [Tr]xSn1‐
- Page 123 and 124: 9.2.3.2. Substitution Trials: [Tr]x
- Page 125 and 126: One can observe a variety of grain
- Page 127 and 128: 9.2.5. Conclusions Drawn from SnBi4
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- Page 131 and 132: 9.4. Project Summary and Future Wor
- Page 133 and 134: Chapter 10. Introduction to Tl5Te3
- Page 135 and 136: Figure 10.2 DOS calculations for Tl
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- Page 141 and 142: sintering of these pellets. A cold
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- Page 149 and 150: Tl/Sn/Bi present in the 4c Wyckoff
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- Page 155 and 156: Chapter 13. Modifications of Tl9SbT
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Section V - Ba Late‐Transition‐
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Obviously, compounds possessing the
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Table 14.1 Known Ba‐Cg‐Q compou
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All samples were analyzed by means
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crystal structure study of the Se
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As emphasized in Figure 15.2 (b), t
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The Cu-Cu COHP curve, cumulated ove
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Chapter 16. Ba3Cu17‐x(S,Te)11 and
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the selenide‐telluride before, th
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surrounded by three Q1 atoms. Besid
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Figure 16.3 The three‐dimensional
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Figure 16.5 Seebeck coefficient (le
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Chapter 17. Ba2Cu7‐xTe6 17.1. Int
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Table 17.1 Crystallographic Data fo
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Table 17.2 Atomic coordinates, Ueq
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17.3.2. Electronic Structure Calcul
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Figure 17.6 Crystal orbital Hamilto
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Section VI - Supplementary Informat
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[33] Rowe, D. M.; Kuznetsov, V. L.;
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[90] Albright, T. A.; Burdett, J. K
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[156] Cottenier, S., Density Functi
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[219] Toure, A. A.; Kra, G.; Eholie
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[294] Kanno, R.; Ohno, K.; Kawamoto
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Table A.3 Atomic positions and Ueq
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Table B.2 Selected interatomic dist
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Table B.5 Atomic coordinates and Ue
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Table B.7 Selected interatomic dist