ISSN:
0020-7608
Keywords:
Computational Chemistry and Molecular Modeling
;
Atomic, Molecular and Optical Physics
Source:
Wiley InterScience Backfile Collection 1832-2000
Topics:
Chemistry and Pharmacology
Notes:
We formulate the current-density functional theory for systems in arbitrarily strong magnetic fields. A set of self-consistent equations comparable to the Kohn-Sham equations for ordinary density functional theory is derived, and proved to be gauge-invariant and to satisfy the continuity equation. These equations of Vignale and Rasolt involve the gauge field corresponding to the external magnetic field as well as a new gauge field generated entirely from the many-body interactions. We next extend this gauge theory (following Rasolt and Vignale) to a lattice Lagrangian believed to be appropriate to a tight-binding Hamiltonian in the presence of an external magnetic field. We finally examine the nature of the ground state of a strongly nonuniform electron gas in the presence of this many-body, self-induced gauge field. © 1992 John Wiley & Sons, Inc.
Additional Material:
1 Ill.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1002/qua.560440831
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