Computational Materials Science From Ab Initio to Monte Carlo Methods /

This textbook introduces modern techniques based on computer simulation to study materials science. It starts from first principles calculations enabling to calculate the physical and chemical properties by solving a many-body Schroedinger equation with Coulomb forces. For the exchange-correlation t...

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Bibliographic Details
Main Authors: Ohno, Kaoru (Author), Esfarjani, Keivan (Author), Kawazoe, Yoshiyuki (Author)
Corporate Author: SpringerLink (Online service)
Format: e-Book
Language:English
Published: Berlin, Heidelberg : Springer Berlin Heidelberg : 2018.
Imprint: Springer,
Edition:2nd ed. 2018.
Subjects:
Optical materials.
Mathematical physics.
Chemistry, Physical and theoretical.
Nanotechnology.
Condensed matter.
Optical Materials.
Theoretical, Mathematical and Computational Physics.
Theoretical Chemistry.
Condensed Matter Physics.
Online Access:Full-text access
Table of Contents:
  • Ab-Initio Methods
  • Tight-Binding Methods
  • Empirical Methods and Coarse-Graining
  • Monte Carlo Methods
  • Quantum Monte Carlo (QMC) Methods.

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