Searched refs:DftDensity (Results 1 – 6 of 6) sorted by relevance
/dports/science/dalton/dalton-66052b3af5ea7225e31178bf9a8b031913c72190/DALTON/dft/ |
H A D | general.h | 42 typedef struct DftDensity_ DftDensity; typedef 45 typedef void (*DftDensEvaluator)(DftDensity* dens, FunDensProp* dp, 132 void dft_dens_restricted (DftDensity* dens, FunDensProp* dp, DftGrid* grid, 134 void dft_dens_unrestricted(DftDensity* dens, FunDensProp* dp, DftGrid* grid,
|
H A D | integrator.h | 62 real dft_integrate_ao(DftDensity* dens, real* work, integer* lwork, integer* iprint,
|
H A D | gen-so-int.c | 119 DftDensity dens = { dft_dens_restricted, NULL, NULL }; in FSYM()
|
H A D | general.c | 524 dft_dens_restricted(DftDensity* dens, FunDensProp* dp, DftGrid* grid, in dft_dens_restricted() 548 dft_dens_unrestricted(DftDensity* dens, FunDensProp* dp, DftGrid* grid, in dft_dens_unrestricted()
|
H A D | integrator.c | 308 dft_integrate_ao(DftDensity* dens, real* work, integer* lwork, integer* iprint, in dft_integrate_ao()
|
H A D | prop-eval.c | 311 DftDensity dens = { dft_dens_restricted, NULL, NULL }; in FSYM2() 426 DftDensity dens = { dft_dens_restricted, NULL, NULL }; in FSYM2() 641 DftDensity dens = { dft_dens_unrestricted, NULL, NULL }; in FSYM2() 984 DftDensity dens = { dft_dens_unrestricted, NULL, NULL }; in FSYM2()
|