Big Chemical Encyclopedia

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

Articles Figures Tables About

The Hartree-Fock approximation in jellium

In the homogeneous electron gas -or jellium- the electrons are assumed to be embedded in a uniform compensating positive background. It is well known that in this case the plane waves  [Pg.14]

These states fill up the Fermi sphere, the radius kp of which is obtained by imposing that the number of states in the Fermi sphere equals the number of electrons, giving  [Pg.14]

The exchange potential which enters in the Hartree-Fock equation (Eq. 10), can be evaluated analytically in this simple case  [Pg.14]

Averaging the exchange potential (Eq. 20) over all the occupied states k kp (replacing the sum by an integral (2n/(27r) ) / because [Pg.14]

Dash-dotted line Kohn-Sham approximation. [Pg.15]


See other pages where The Hartree-Fock approximation in jellium is mentioned: [Pg.14]   


SEARCH



Hartree approximation

Hartree-Fock approximation

Jellium

Jellium approximation

The Approximations

The Hartree Approximation

© 2024 chempedia.info