PROGRAM SUMMARY
Title of program:
QDHartreeFock.nb v 1.0
Catalogue identifier:
ADPE
Ref. in CPC:
141(2001)175
Distribution format: tar gzip file
High speed store required:
800K words
Number of lines in distributed program, including test data, etc:
3043
Keywords:
Hartree-Fock method, Quantum dot, Artificial atom,
Electronic structure, Atomic physics, Wave function.
Programming language used: Mathematica
Computer:
DEC Alpha workstation500.
Nature of physical problem:
Electronic structure of N-electrons confined in a quantum dot.
Method of solution:
The Hartree-Fock self-consistent field method is applied to the physical
problem. The Rayleigh-Ritz variational method is applied to solve the
Hartree-Fock equations, using a mixture of analytic and numeric
computational techniques.
Restrictions:
Restricted to circularly symmetric quantum dots; limited matrix
(expansion) sizes.
Unusual features:
A simple input structure. Analytic reduction of direct and exchange
integrals speeds up computation and improves accuracy.