Quantum dots in two dimensions and the "strictly correlated electrons" (SCE) framework
C source code (with minor improvements) and Mathematica demonstration file
quantum_dot_demo.nb for the calculations in Ref. 1: Kohn-Sham density functional theory using the "strictly correlated electrons" (SCE) functional applied to quantum dots in two dimensions. The program uses the Mathematica MathLink interface and requires a BLAS/LAPACK library, for example AMD's Core Math Library (ACML), as well as the GNU Scientific Library (GSL).
How to compile the source code:
- Windows: Visual Studio 2013 project files are provided in the vcproj_mlink subfolder
- Linux: a makefile is available in the mlink subfolder. You probably have to adapt paths and the BLAS/LAPACK function calls to your local installation
Copyright (c) 2013-2014, Christian B. Mendl
All rights reserved.
This program is free software; you can redistribute it and/or modify it under the terms of the Simplified BSD License http://www.opensource.org/licenses/bsd-license.php
- Christian B. Mendl, Francesc Malet, Paola Gori-Giorgi
Wigner localization in quantum dots from Kohn-Sham density functional theory without symmetry breaking
Phys. Rev. B 89, 125106 (2014), arXiv:1311.6011
- Michael Seidl, Paola Gori-Giorgi, Andreas Savin
Strictly correlated electrons in density-functional theory: A general formulation with applications to spherical densities
Phys. Rev. A 75, 042511 (2007), arXiv:cond-mat/0701025