ML1-PYSCF

FUNCTIONAL NAME: ML1-PYSCF


This is a CORRELATION Density Functional Theory functional


FUNCTIONAL FAMILY: LDA


DESCRIPTION: Modified LSD (version 1) of Proynov and Salahub. PySCF variant.




REFERENCES


E. I. Proynov and D. R. Salahub., Phys. Rev. B 49, 7874 (1994)

DOI: 10.1103/PhysRevB.49.7874


E. I. Proynov and D. R. Salahub., Phys. Rev. B 57, 12616–12616 (1998)

DOI: 10.1103/PhysRevB.57.12616