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Books > Science & Mathematics > Physics > Quantum physics (quantum mechanics)
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Band Structure of Cubic Hydrides (Hardcover, 1st ed. 2023)
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Band Structure of Cubic Hydrides (Hardcover, 1st ed. 2023)
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This book compiles detailed results of electronic structure
calculations for most possible cubic monohydrides, dihydrides and
selected trihydrides related to superconductivity, comprising
elements with atomic numbers up to 103. Beginning with an
introduction to the theory and details of the computational methods
implemented, this handbook presents a collection of chapters
containing results for different classes of cubic hydrides,
featuring tables of three-centre and two-centre tight-binding
parameterizations, diagrams of energy bands, and densities of
states with angular momentum decomposition. Equilibrium lattice
parameters and bulk moduli are also included, along with the
electron-ion matrix element (Hopfield-McMillan parameter), Stoner
criterion for ferromagnetism and values of Fermi velocities and
plasmon energies. Each chapter features a brief text explaining the
results presented with comparison to experimental values when
available. A selection of the implemented computer codes is
reproduced for the reader's own use. This handbook is an ideal
complement to any standard electronic structure text for students
and researchers in materials science, condensed matter physics, and
quantum chemistry.
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