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 review and update a recently developed one-particle theory of N-electron systems that bears a certain resemblance to density functional (DF) theory and has been put forward by the present author. As distinct from DF theory, the new one-particle scheme applies to any N-electron eigenstate including the ground state. For the latter case, the key equations become identical to those familiar from the Kohn-Sham version of DF theory. The theory given here constitutes the basis for a consistent treatment of normal conductivity and superconductivity, which will be discussed in Part II of this article. © 1993 John Wiley & Sons, Inc.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1002/qua.560480304
