functionals

Functions

Chachiyo(box_vecs, den)	Chachiyo functional
G_inv_gap(box_vecs, den, E_gap)	Linear response function of a gapped jellium.
G_inv_lind(eta)
G_inv_lind_analytical(eta)
G_inv_lindhard(box_vecs, den)
Hartree(box_vecs, den)	Hartree energy functional
IonElectron(box_vecs, den, v_ext)	Ion-electron energy functional
IonIon()	Ion-ion interaction energy
KGAP(box_vecs, den, E_gap[, f])	KGAP functional
LuoKarasievTrickey(box_vecs, den)	Luo-Karasiev-Trickey (LKT) functional
PerdewBurkeErnzerhof(box_vecs, den)	Perdew-Burke-Ernzerhof (PBE) functional
PerdewWang(box_vecs, den)	Perdew-Wang (PW) functional
PerdewZunger(box_vecs, den)	Perdew-Zunger (PZ) functional
Perrot(box_vecs, den)	Perrot functional
SmargiassiMadden(box_vecs, den)	Smargiassi-Madden (SM) functional
ThomasFermi(box_vecs, den)	Thomas-Fermi functional
WangGovindCarter98(box_vecs, den)	Wang-Govind-Carter 98 (WGC98) functional
WangTeter(box_vecs, den)	Wang-Teter (WT) functional
Weizsaecker(box_vecs, den)	von Weizsaecker functional
XuWangMa(box_vecs, den[, kappa])	Xu-Wang-Ma (XWM) functional
chachiyo_correlation(box_vecs, den)
lda_exchange(box_vecs, den)
non_local_KEF(box_vecs, den, alpha, beta)
pbe_correlation(box_vecs, den)
pbe_exchange(box_vecs, den)
perdew_wang_correlation(box_vecs, den)
perdew_zunger_correlation(box_vecs, den)
vWGTF1(box_vecs, den)	vWGTF1 functional
vWGTF2(box_vecs, den)	vWGTF2 functional

Classes

FoleyMadden	Foley-Madden (FM) functional
HuangCarter	Huang-Carter (HC) functional
KineticFunctional	Template kinetic functional class
MiGenovaPavanello	Mi-Genova-Pavanello (MGP) functional
PauliGaussian	Pauli-Gaussian functional
RevisedHuangCarter	revised Huang-Carter (revHC) functional
WangGovindCarter99	Wang-Govind-Carter 99 (WGC99) functional
WangTeterStyleFunctional	Wang-Teter style functional
YukawaGGA	Yukawa GGA functional