Non-Abelian density functional theory

DOI10.1088/0305-4470/31/44/017zbMATH Open1097.81524arXivnucl-th/9909070OpenAlexW1992034589MaRDI QIDQ3836086FDOQ3836086

Authors: Ts. Dankova, G. Rosensteel 

Publication date: 6 December 1999

Published in: Journal of Physics A: Mathematical and General (Search for Journal in Brave)

Abstract: Given a vector space of microscopic quantum observables, density functional theory is formulated on its dual space. A generalized Hohenberg-Kohn theorem and the existence of the universal energy functional in the dual space are proven. In this context ordinary density functional theory corresponds to the space of one-body multiplication operators. When the operators close under commutation to form a Lie algebra, the energy functional defines a Hamiltonian dynamical system on the coadjoint orbits in the algebra's dual space. The enhanced density functional theory provides a new method for deriving the group theoretic Hamiltonian on the coadjoint orbits from the exact microscopic Hamiltonian.

Full work available at URL: https://arxiv.org/abs/nucl-th/9909070

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Mathematics Subject Classification ID

Computational methods for problems pertaining to quantum theory (81-08) General mathematical topics and methods in quantum theory (81Q99) Molecular physics (81V55)

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