OB-PW

FUNCTIONAL NAME: OB-PW


This is a CORRELATION Density Functional Theory functional


FUNCTIONAL FAMILY: LDA


DESCRIPTION: Ortiz & Ballone (PW parametrization)




REFERENCES


G. Ortiz and P. Ballone., Phys. Rev. B 50, 1391 (1994)

DOI: 10.1103/PhysRevB.50.1391


G. Ortiz and P. Ballone., Phys. Rev. B 56, 9970 (1997)

DOI: 10.1103/PhysRevB.56.9970


J. P. Perdew and Y. Wang., Phys. Rev. B 45, 13244 (1992)

DOI: 10.1103/PhysRevB.45.13244


Added extra digits to some constants as in the PBE routine (http://dft.rutgers.edu/pubs/PBE.asc).