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Article << Previous     |     Next >>   Contents Vol 53(4)

A Novel Constraint for the Simplified Description of Dispersion Forces

John F. Dobson, Bradley P. Dinte, Jun Wang and Tim Gould

Australian Journal of Physics 53(4) 575 - 596

Abstract

We propose a novel use of an exact constraint in the construction of simple approximations for response functions of interacting many-electron systems. Within its simplest local version, the resulting theory gives improved approximations for static atomic dipolar polarisabilities without the direct use of wavefunctions or semi-empirical cutoffs. It leads to correct van der Waals energies between distant planar systems, but over-corrects existing cutoff theories for the van der Waals C 6 coefficient for atoms. It is argued that a nonlocal-response version of the constrained theory will do better.



Full text doi:10.1071/PH00046

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