Title Band Structure of Cubic Hydrides Author(s) Papaconstantopoulos, Dimitrios A Publication Cham, 1. Imprint: Springer 2. Springer International Publishing, 2023. Description XIII, 688 p. 1088 illus., 149 illus. in color : online resource Abstract Note 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 ISBN,Price 9783031068782 Keyword(s) 1. Density Functional Theory 2. Density functionals 3. EBOOK - SPRINGER 4. ELECTRONIC STRUCTURE 5. Electronic Structure Calculations 6. MATERIALS SCIENCE 7. QUANTUM CHEMISTRY 8. QUANTUM PHYSICS Item Type eBook Multi-Media Links media link description Circulation Data Accession#   Call# Status Issued To Return Due On Physical Location I12612     On Shelf