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The Formulation of Density Functional Theory

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Condensed Matter Theories

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Abstract

We have generalized the formulation of density functional theory in a form suitable for multiconfiguration calculations, and for the calculation of electric and magnetic response functions. The method allows the direct calculation of mixed valence states, spectra (and not just the energy eigenvalues and their differences) and in general, of the elementary excitations of the system.

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References

  1. E. Kryachko, present volume and see, for example, Density Functional Theory, J. Keller and J.L. Gázquez, Eds., Lecture Notes in Physics, Vol. 187 (Springer-Verlag, New York, 1983).

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  5. J. Keller, Journal of Molecular Structure (1988) in press.

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© 1988 Plenum Press, New York

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Keller, J., Amador, C. (1988). The Formulation of Density Functional Theory. In: Arponen, J.S., Bishop, R.F., Manninen, M. (eds) Condensed Matter Theories. Springer, Boston, MA. https://doi.org/10.1007/978-1-4613-0971-0_18

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  • DOI: https://doi.org/10.1007/978-1-4613-0971-0_18

  • Publisher Name: Springer, Boston, MA

  • Print ISBN: 978-1-4612-8271-6

  • Online ISBN: 978-1-4613-0971-0

  • eBook Packages: Springer Book Archive

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