pseudo.F90 File Reference

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Modules
module	pseudo_oct_m

Data Types
type	pseudo_oct_m::pseudo_t
interface	pseudo_oct_m::pseudo_detect_format
interface	pseudo_oct_m::pseudo_init
interface	pseudo_oct_m::pseudo_end
interface	pseudo_oct_m::pseudo_type
interface	pseudo_oct_m::pseudo_format
interface	pseudo_oct_m::pseudo_valence_charge
interface	pseudo_oct_m::pseudo_mesh_spacing
interface	pseudo_oct_m::pseudo_mesh_size
interface	pseudo_oct_m::pseudo_mass
interface	pseudo_oct_m::pseudo_lmax
interface	pseudo_oct_m::pseudo_llocal
interface	pseudo_oct_m::pseudo_nchannels
interface	pseudo_oct_m::pseudo_nprojectors
interface	pseudo_oct_m::pseudo_nprojectors_per_l
interface	pseudo_oct_m::pseudo_grid
interface	pseudo_oct_m::pseudo_grid_weights
interface	pseudo_oct_m::pseudo_local_potential
interface	pseudo_oct_m::pseudo_projector
interface	pseudo_oct_m::pseudo_dij
interface	pseudo_oct_m::pseudo_radial_potential
interface	pseudo_oct_m::pseudo_radial_function
interface	pseudo_oct_m::pseudo_nlcc_density
interface	pseudo_oct_m::pseudo_density
interface	pseudo_oct_m::pseudo_nwavefunctions
interface	pseudo_oct_m::pseudo_wavefunction
interface	pseudo_oct_m::pseudo_exchange
interface	pseudo_oct_m::pseudo_correlation
interface	pseudo_oct_m::pseudo_projector_2j
interface	pseudo_oct_m::pseudo_wavefunction_2j

Functions/Subroutines
logical function, public	pseudo_oct_m::pseudo_has_nlcc (pseudo)
logical function, public	pseudo_oct_m::pseudo_has_density (pseudo)
logical pure function, public	pseudo_oct_m::pseudo_has_total_angular_momentum (pseudo)
logical function, public	pseudo_oct_m::pseudo_has_radial_function (pseudo, l)

Variables
integer, parameter, public	pseudo_oct_m::pseudo_type_ultrasoft = 30
integer, parameter, public	pseudo_oct_m::pseudo_type_semilocal = 31
integer, parameter, public	pseudo_oct_m::pseudo_type_kleinman_bylander = 32
integer, parameter, public	pseudo_oct_m::pseudo_type_paw = 33
integer, parameter, public	pseudo_oct_m::pseudo_status_success = 0
integer, parameter, public	pseudo_oct_m::pseudo_status_file_not_found = 455
integer, parameter, public	pseudo_oct_m::pseudo_status_format_not_supported = 456
integer, parameter, public	pseudo_oct_m::pseudo_status_unknown_format = 457
integer, parameter, public	pseudo_oct_m::pseudo_status_unsupported_type_ultrasoft = 458
integer, parameter, public	pseudo_oct_m::pseudo_status_unsupported_type_paw = 459
integer, parameter, public	pseudo_oct_m::pseudo_status_unsupported_type = 460
integer, parameter, public	pseudo_oct_m::pseudo_format_file_not_found = 773
integer, parameter, public	pseudo_oct_m::pseudo_format_unknown = 774
integer, parameter, public	pseudo_oct_m::pseudo_format_upf1 = 775
integer, parameter, public	pseudo_oct_m::pseudo_format_upf2 = 776
integer, parameter, public	pseudo_oct_m::pseudo_format_qso = 777
integer, parameter, public	pseudo_oct_m::pseudo_format_psml = 778
integer, parameter, public	pseudo_oct_m::pseudo_format_psf = 779
integer, parameter, public	pseudo_oct_m::pseudo_format_cpi = 780
integer, parameter, public	pseudo_oct_m::pseudo_format_fhi = 781
integer, parameter, public	pseudo_oct_m::pseudo_format_hgh = 782
integer, parameter, public	pseudo_oct_m::pseudo_format_psp8 = 783
integer, parameter, public	pseudo_oct_m::pseudo_exchange_unknown = -2
integer, parameter, public	pseudo_oct_m::pseudo_exchange_any = -1
integer, parameter, public	pseudo_oct_m::pseudo_correlation_unknown = -2
integer, parameter, public	pseudo_oct_m::pseudo_correlation_any = -1