5.50. xc.lda_xc_ksdtΒΆ

KSDT LDA exchange-correlation.

Reference: Phys. Rev. Lett. 112, 076403.

Classes

Coefficients

Coefficients class to calculate temperature/theta dependent coefficients.

PhiParams

Parameter class holding the spin-interpolation function parameters.

Zeta0Coeffs

Coefficient class using the parameters for zeta=0.

Zeta1Coeffs

Coefficient class using the parameters for zeta=1.

Functions

lda_xc_ksdt

KSDT exchange-correlation functional (spin-polarized).

lda_xc_ksdt_spin

KSDT exchange-correlation functional (spin-polarized).