Temperature and Frequency Dependence of Complex Permittivity in Metal Oxide Dielectrics: Theory, Modelling and Measurement (eBook)

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2016 | 1st ed. 2016
XX, 167 Seiten
Springer International Publishing (Verlag)
978-3-319-44547-2 (ISBN)

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Temperature and Frequency Dependence of Complex Permittivity in Metal Oxide Dielectrics: Theory, Modelling and Measurement - Jonathan Breeze
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This thesis investigates the dielectric properties of metal-oxide ceramics at microwave frequencies. It also demonstrates for the first time that a theory of harmonic phonon coupling can effectively predict the complex permittivity of metal oxides as a function of temperature and frequency. Dielectric ceramics are an important class of materials for radio-frequency, microwave and emergent terahertz technologies. Their key property is complex permittivity, the real part of which permits the miniaturisation of devices and the imaginary part of which is responsible for the absorption of electromagnetic energy. Absorption limits the practical performance of many microwave devices such as filters, oscillators, passive circuits and antennas. Complex permittivity as a function of temperature for low-loss dielectrics is determined by measuring the resonant frequency of dielectric resonators and using the radial mode matching technique to extract the dielectric properties.

There have been only a handful of publications on the theory of dielectric loss, and their predictions have often been unfortunately unsatisfactory when compared to measurements of real crystals, sometimes differing by whole orders of magnitude. The main reason for this is the lack of accurate data for a harmonic coupling coefficient and phonon eigenfrequencies at arbitrary q vectors in the Brillouin zone. 

Here, a quantum field theory of losses in dielectrics is applied, using results from density functional perturbation theory, to predict from first principles the complex permittivity of metal oxides as functions of frequency and temperature. 




My principal research interests lie in room-temperature maser, the measurement and modelling of the dielectric properties of microwave dielectric materials, the design of high Q-factor and Purcell-factor resonators and density functional calculations of materials. Other research areas are microwave filter design, photonic bandgap structures, metamaterials and the measurement of the electrical and magnetic properties of thin films at microwave frequencies. 


My principal research interests lie in room-temperature maser, the measurement and modelling of the dielectric properties of microwave dielectric materials, the design of high Q-factor and Purcell-factor resonators and density functional calculations of materials. Other research areas are microwave filter design, photonic bandgap structures, metamaterials and the measurement of the electrical and magnetic properties of thin films at microwave frequencies. 

Supervisor’s Foreword 6
Abstract 8
Acknowledgements 9
Contents 10
List of Figures 13
List of Tables 17
1 Introduction 19
1.1 The Radio Revolution 19
1.2 Metal Oxide Microwave Dielectric Ceramics 21
1.3 Review of Dielectric Loss 22
1.4 Structure of Thesis 27
1.5 Publications by the Author 28
References 28
2 Modelling Dielectric Resonators 31
2.1 Introduction to Microwave Dielectrics 31
2.2 Measuring Microwave Dielectric Properties 33
2.3 Modelling Shielded Dielectric Resonators 34
2.4 Maxwell Equations in Cylindrical Coordinates 37
2.5 Multilayer Waveguide Eigenvalues 43
2.6 The Radial Mode Matching Method 49
2.7 Calculating Resonator Losses 54
2.8 Example Resonator 57
2.9 Summary and Conclusions 58
References 59
3 Measurement of Dielectric Properties 60
3.1 Dielectric Resonator Measurements 60
3.2 Calculating Dielectric Properties 63
3.3 Cryogenic Measurements 65
3.4 Characterisation of Ag-Plated Cavity 68
3.5 Characterisation of Single-Crystal Quartz Support 70
3.6 Magnesium Oxide --- MgO 71
3.7 Lanthanum Aluminate --- LaAlO3 73
3.8 Titanium Dioxide (Rutile) --- TiO2 76
3.9 Aluminium Oxide (Sapphire) --- Al2O3 79
3.10 Summary and Conclusions 82
References 82
4 Lattice Dynamics and Density Functional Perturbation Theory 85
4.1 Lattice Dynamics 86
4.2 Hamiltonian of a System of Ions and Electrons 87
4.3 The Born--Oppenheimer Approximation 87
4.4 Hellmann--Feynman Theorem 88
4.5 Hohenberg--Kohn Theorem 90
4.6 Kohn--Sham Orbitals 90
4.7 The Local Density Approximation 91
4.8 Linear Response DFT 92
4.9 Phonon Modes in Crystals 94
4.10 Long-Wavelength Phonons and Electric Fields 96
4.11 Implementation 99
4.12 The Lydanne-Sachs-Teller Relation 100
4.13 Summary and Conclusions 101
References 102
5 Harmonic Properties of Metal Oxide Dielectrics 103
5.1 Magnesium Oxide --- MgO 103
5.2 Lanthanum Aluminate --- LaAlO3 111
5.3 Titanium Dioxide (Rutile) --- TiO2 113
5.4 Aluminium Oxide (Sapphire) --- ?-Al2O3 120
5.5 Summary and Conclusions 123
References 124
6 Theory of Anharmonic Phonons 126
6.1 Beyond the Harmonic Approximation 127
6.2 Anharmonic Hamiltonian 128
6.3 Quantum Field Theory of Anharmonic Phonons 132
6.4 The Evolution Operator 135
6.5 Graphical Representation of Green Functions 137
6.6 Evaluating Matsubara Sums 137
6.7 The Self Energy, ? 138
6.7.1 Loop Interaction 139
6.7.2 Bubble Interaction 140
6.7.3 Higher Order Interactions 143
6.8 Dyson's Equation and Dressed Phonons 145
6.9 Summary and Conclusions 147
References 147
7 Anharmonic Properties of MgO 149
7.1 Introduction 149
7.2 Self-energy of Phonons 149
7.3 The Effect of Isotopes on Self-energy 152
7.4 Linear Coefficient of Thermal Expansion 153
7.5 Thermal Strain Contribution to Phonon Self-energy 157
7.6 Temperature Coefficient of Permittivity 158
7.7 Dielectric Loss 159
7.8 Phonon--Phonon Contribution to the Self-energy 160
7.9 Two-Phonon Density of States 162
7.10 Energy Conservation Surfaces 163
7.11 Weighted Two-Phonon Density of States 166
7.12 Anharmonic Phonon Coupling Tensors 167
7.13 The Relaxation Frequency, ? 169
7.13.1 Frequency Dependence 170
7.13.2 Temperature Dependence 173
7.14 Summary and Conclusions 176
References 176
8 Discussion and Conclusions 178

Erscheint lt. Verlag 8.9.2016
Reihe/Serie Springer Theses
Zusatzinfo XX, 167 p. 78 illus., 27 illus. in color.
Verlagsort Cham
Sprache englisch
Themenwelt Naturwissenschaften Physik / Astronomie
Technik Maschinenbau
Schlagworte Complex Permittivity Dielectrics • Complex Permittivity in Low-loss Dielectrics • Complex Permittivity of Metal-oxides • Density Functional Perturbation Theory • Dielectric Ceramics • Dielectric Properties of Metal-oxide Ceramics • Electromagnetic Energy Dielectrics • Emergent Terahertz Technologies • Resonant Frequency of Dielectric Resonators
ISBN-10 3-319-44547-2 / 3319445472
ISBN-13 978-3-319-44547-2 / 9783319445472
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