Big Chemical Encyclopedia

Chemical substances, components, reactions, process design ...

Articles Figures Tables About

Convergence of DKH Energies and Variational Stability

It has already been stated in chapter 11 that an expansion in the formal parameter 1 /c is invalid because of the linear momentum associated with this formal expansion parameter. The only other remaining parameter V is the basis for [Pg.477]

While DKH (energy) expectation values converge smoothly to the Dirac reference, the DKH eigenfunctions (beyond first order) feature a weakly singular behavior at a point-like atomic nucleus [639,640] as the Dirac spinors do (the latter we have discussed in chapter 6). Only for a finite nucleus, the DKH eigenfunctions will feature a zero slope at the nucleus center. [Pg.478]


See other pages where Convergence of DKH Energies and Variational Stability is mentioned: [Pg.477]   


SEARCH



Variation energy

Variational energy

Variational energy convergence

© 2024 chempedia.info