Title: Lectures on methods of electronic structure calculations :
Authors: Miniworkshop on "Methods of Electronic Structure Calculations"; Kumar, Vijay,; Andersen, O. K.; Mookerjee, Abhijit,; Working Group on "Disordered Alloys"
Date: 1994
Publisher: World Scientific,
Physical description: viii, 386 pages : illustrations ; 23 cm
Language: English
Contents: Density Functional Theory: Many-Body Effects Without Tears / M. P. Das -- Different Approximations Within Density Functional Theory, Their Advantages and Limitations / U. von Barth -- Exact Muffin-Tin Orbital Theory / O. K. Andersen, O. Jepsen and G. Krier -- Solving Electronic Structure Problems with the Recursion Method / R. Haydock -- Real Space Electronic Structure Calculation Using the Recursion Method / P. Vargas C. -- The Augmented Space and Electronic Structure of Random Binary Alloys / A. Mookerjee -- KKR Approach to Random Alloys / R. Prasad -- Self-Consistent Green's Function Method for Random Alloys and Their Surfaces / J. Kudrnovsky, I. Turek and V. Drchal -- Magnetism and Compositional Order in Transition Metal Alloys / J. B. Staunton, B. L. Gyorffy, D. D. Johnson, F. J. Pinski and G. M. Stocks -- First Principles Investigation of Epitaxial Interfaces Using LMTO-Supercell Approach / G. P. Das -- Ab-Initio Molecular-Dynamics: The Car-Parrinello Method / G. Pastore. Atomic and Electronic Structure of Clusters from Car-Parrinello Method / V. Kumar -- Car-Parrinello MD with Vanderbilt's Ultrasoft Pseudopotentials / K. Laasonen.
Subject headings (LCSH): Density functionals.; Electronic structure--Congresses.; Electronic structure.; Order-disorder in alloys--Congresses.