LP96-NWCHEM

FUNCTIONAL NAME: LP96-NWCHEM

This is a CORRELATION Density Functional Theory functional

FUNCTIONAL FAMILY: LDA

DESCRIPTION: Liu-Parr correlation. NWChem variant.

REFERENCES

S. Liu and R. G. Parr., Phys. Rev. A 53, 2211–2219 (1996)

DOI: 10.1103/PhysRevA.53.2211

S. Liu and R.G Parr., J. Mol. Struct.: THEOCHEM 501–502, 29 - 34 (2000)

DOI: 10.1016/S0166-1280(99)00410-8