MPQC
3.0.0-alpha
|
This is the complete list of members for ShellData, including all inherited members.
DEFINE_PROPERTIES(ShellData, int,((bfoff)(basis->shell_to_function(index);))((nbf)(basis->shell(index).nfunction();))((center)(basis->shell_to_center(index);))((atom_shoff)(basis->shell_on_center(center, 0);))((atom_bfoff)(basis->shell_to_function(atom_shoff);))((atom_nsh)(basis->nshell_on_center(center);))((atom_nbf)(basis->nbasis_on_center(center);))((shoff_in_atom)(index - atom_shoff;))((bfoff_in_atom)(bfoff - atom_bfoff;))((atom_last_function)(atom_bfoff+atom_nbf - 1;))((atom_last_shell)(atom_shoff+atom_nsh - 1;))((last_function)(bfoff+nbf - 1;))(CONDITIONAL_PROPERTIES(dfbasis !=0,((atom_dfshoff)(dfbasis->shell_on_center(center, 0);))((atom_dfbfoff)(dfbasis->shell_to_function(atom_dfshoff);))((atom_dfnsh)(dfbasis->nshell_on_center(center);))((atom_dfnbf)(dfbasis->nbasis_on_center(center);))((atom_df_last_function)(atom_dfbfoff+atom_dfnbf - 1;))((atom_df_last_shell)(atom_dfshoff+atom_dfnsh - 1;)))), init) (defined in ShellData) | ShellData | |
operator const int() const (defined in ShellData) | ShellData | inline |
operator int() (defined in ShellData) | ShellData | inline |
operator*() const (defined in ShellData) | ShellData | inline |
operator++() (defined in ShellData) | ShellData | inline |
operator=(const ShellData &other) (defined in ShellData) | ShellData | inline |
set_index(int idx) (defined in ShellData) | ShellData | inline |
ShellData() (defined in ShellData) | ShellData | inline |
ShellData(int idx, GaussianBasisSet *basis, GaussianBasisSet *dfbasis=0) (defined in ShellData) | ShellData | inline |
ShellData(const ShellData &other) (defined in ShellData) | ShellData | inline |