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Electron states | |
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The quantum-mechanical basis | |
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Quantum mechanics | |
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Electronic structure of atoms | |
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Electronic structure of small molecules | |
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The simple polar bond | |
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Diatomic molecules | |
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Electronic structure of solids | |
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Energy bands | |
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Electron dynamics | |
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Characteristic solid types | |
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Solid state matrix elements | |
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Calculation of spectra | |
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Covalent solids | |
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Electronic structure of simple tetrahedral solids | |
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Crystal structures | |
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Bond orbitals | |
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The LCAO bands | |
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The bond orbital approximation and extended bond orbitals | |
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Metallicity | |
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Planar and filamentary structures | |
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Optical spectra | |
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Dielectric susceptibility | |
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Optical properties and oscillator strengths | |
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Features of the absorption spectrum | |
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chi subscript 1 and the dielectric constant | |
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Other dielectric properties | |
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Bond dipoles and higher-order susceptibilities | |
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Effective atomic charge | |
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Dielectric screening | |
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Ternary compounds | |
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Magnetic susceptibility | |
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The energy bands | |
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Accurate band structures | |
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LCAO Interpretation of the bands | |
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The conduction bands | |
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Effective masses | |
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Impurity states and excitons | |
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The total energy | |
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The overlap interaction | |
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Bond length, cohesive energy, and the bulk modulus | |
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Cohesion in polar covalent solids | |
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Elasticity | |
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Total energy calculations | |
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Rigid hybrids | |
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Rehybridization | |
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The Valence force field | |
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Internal displacements, and prediction of c subscript 44 | |
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Lattice Vibrations | |
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The Vibration spectrum | |
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Long range forces | |
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Phonons and the specific heat | |
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The transverse charge | |
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Piezoelectricity | |
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The Electron-phonon interaction | |
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Surfaces and defects | |
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Surface energy and crystal shapes | |
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Surface reconstruction | |
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The elimination of surface states, and Fermi level pinning | |
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Adsorption of atoms and the 7 x 7 reconstruction pattern | |
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Defects and amorphous semiconductors | |
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Photothresholds and heterojunctions | |
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Mixed tetrahedral solids | |
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Tetrahedral complexes | |
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The crystal structure and the simple molecular lattice | |
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The bonding unit | |
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Bands and electronic spectra | |
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Mechanical properties | |
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Vibrational spectra | |
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Coupling of vibrations to the infrared | |
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Closed-shell systems | |
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Inert-gas solids | |
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Interatomic interactions | |
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Electronic properties | |
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Ionic compounds | |
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The crystal structure | |
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Electrostatic energy and the Madelung potential | |
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Ion-Ion Interactions | |
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Cohesion and Mechanical Properties | |
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Structure Determination and Ionic Radii | |
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Dielectric properties of ionic crystals | |
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Electronic structure and spectra | |
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Dielectric susceptibility | |
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Effective charges and ion softening | |
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Surfaces and molten ionic compounds | |
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Open-shell systems | |
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Simple metals | |
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History of the theory | |
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The Free-electron theory of metals | |
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Electrostatic energy | |
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The empty-core pseudopotential | |
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Free-electron energy | |
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Density, bulk modulus, and cohesion | |
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Electronic structure of metals | |
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Pseudopotential perturbation theory | |
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Pseudopotentials in the perfect lattice | |
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Electron diffraction by pseudopotentials | |
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Nearly-free-electron bands and Fermi surfaces | |
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Scattering by defects | |
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Screening | |
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Mechanical properties of metals | |
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The band-structure energy | |
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The effective interaction between ions, and higher-order terms | |
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The phonon spectrum | |
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The electron-phonon interaction and the electron-phonon coupling constant | |
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Surfaces and liquids | |
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Pseu | |