Many-Electron Approaches in Physics, Chemistry and Mathematics A Multidisciplinary View /

• Συγγραφή απο Οργανισμό/Αρχή: SpringerLink (Online service)
• Άλλοι συγγραφείς: Bach, Volker (Επιμελητής έκδοσης), Delle Site, Luigi (Επιμελητής έκδοσης)
• Μορφή: Ηλεκτρονική πηγή Ηλ. βιβλίο
• Γλώσσα: English
• Έκδοση: Cham : Springer International Publishing : Imprint: Springer, 2014.
• Σειρά: Mathematical Physics Studies,
• Θέματα: Physics.; Chemistry, Physical and theoretical.; Computers.; Mathematical physics.; Theoretical, Mathematical and Computational Physics.; Theoretical and Computational Chemistry.; Mathematical Physics.; Computing Methodologies.

This book provides a broad description of the development and (computational) application of many-electron approaches from a multidisciplinary perspective. In the context of studying many-electron systems Computer Science, Chemistry, Mathematics and Physics are all intimately interconnected. However...

Πίνακας περιεχομένων:

• Topics in Quantum Chemistry
• Relativistic Quantum Theory of Many-Electron Systems
• Spurious Modes in Dirac Calculations and how to avoid them
• Tensor product approximation (DMRG) and Coupled Cluster Method in Quantum Chemistry
• Quantum Cluster Equilibrium
• Linear Response Methods in Quantum Chemistry
• Topics in Density Functional Theory and Related Approaches
• Progress on New Approaches to Old Ideas: Orbital-free Density Functionals
• Time-dependent Density Functional Theory
• Density Functional Theory for Strongly-Interacting Electrons
• Towards the Computational Design of Compounds from First Principles
• Application of (Kohn-Sham) Density Functional Theory to Real Materials
• The Quantum Energy agrees with the Muller Energy up to the Third Order
• Mathematical Aspects of Density Functionals and Density Matrix Functionals in Quantum Chemistry
• Some (important?) unsolved Mathematical Problems in Molecular Simulation.- Topics in Computer Science
• The Computational Complexity of Density Functional Theory
• Computational Techniques for Density Functional-based Molecular Dynamics Calculations in Plane-Wave and Localized Basis Sets
• Information Theory in Many-Electron Descriptions
• Towards the Information-Theoretic Construction of an Orbital-free Kinetic Energy Functional
• Lieb-Robinson Bounds and Simulation of Time Evolution of Local Observables in Lattice Systems
• Green Function-based Approaches
• Electronic Structure Calculations with LDA+DMFT
• The GW Approximation for the Electronic Self-Energy
• Topics in Quantum Monte Carlo and Related Approaches
• Levy-Lieb Principle meets Quantum Monte Carlo
• The new Resonating Valence Bond Method for ab-initio Electronic Simulations. Mathematical Perspective on Quantum Monte Carlo Methods
• Open Problems: A wish list of Mel Levy and Elliot Lieb.