Index

C

CADMium module, [1] CADMium.kohnsham module CADMium.partition module CADMium.psgrid module CADMium.pssolver module

calc_chempot() (CADMium.Kohnsham method) calc_density() (CADMium.Kohnsham method) calc_hxc_potential() (CADMium.Kohnsham method) calc_nuclear_potential() (CADMium.Kohnsham method) (CADMium.Partition method) calc_protomolecule() (CADMium.Partition method) calc_Q() (CADMium.Partition method) calc_scale_factors() (CADMium.Partition method)

E

energy() (CADMium.Kohnsham method)

F

factorize_laplacian() (CADMium.Psgrid method), [1]

finite_difference_1d() (CADMium.Psgrid method), [1] finite_difference_2d() (CADMium.Psgrid method), [1]

I

initialguessinvert() (CADMium.Partition method) initialize() (CADMium.Psgrid method), [1]

integrate() (CADMium.Psgrid method), [1] invert() (CADMium.Inverter method) Inverter (class in CADMium)

K

Kohnsham (class in CADMium)

L

linresponse() (CADMium.Inverter method)

M

mirror() (CADMium.Psgrid method), [1] mirrorAB() (CADMium.Partition method) module CADMium, [1] CADMium.kohnsham CADMium.partition CADMium.psgrid CADMium.pssolver

O

operators() (CADMium.Psgrid method), [1]

P

Partition (class in CADMium) partition_potential() (CADMium.Partition method)

plotter() (CADMium.Psgrid method), [1] Psgrid (class in CADMium) Pssolver() (in module CADMium)

R

reduced_grad() (CADMium.Psgrid method), [1]

S

scf() (CADMium.Kohnsham method) (CADMium.Partition method) set_effective_potential() (CADMium.Kohnsham method)

sigma() (CADMium.Psgrid method), [1] spinflip() (CADMium.Psgrid method), [1] square() (CADMium.Psgrid method), [1]

V

vp_kinetic() (CADMium.Partition method)

vp_nuclear() (CADMium.Partition method)