sc::ShellExtent

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Version 2.3.1                                    Sun Oct 4 2020                               sc::ShellExtent(3)

conststd::vector<ExtentData>&sc::ShellExtent::contributing_shells(intx,inty,intz)[inline]
       Returns the shells that are nonzero at coordinates x, y, z. The shells numbers are in ascending order.

       sc::ShellExtent

       Inherits sc::RefCount.

   PublicMemberFunctions
       void init (const Ref< GaussianBasisSet > &, double resolution=1.0, double tolerance=DBL_EPSILON)
       const std::vector< ExtentData > & contributing_shells (int x, int y, int z)
           Returns the shells that are nonzero at coordinates x, y, z.
       const std::vector< ExtentData > & contributing_shells (double x, double y, double z)
       void print (std::ostream &o=ExEnv::out0())
       const int * n () const
       int n (int ixyz) const
       double lower (int ixyz) const
       double upper (int ixyz) const
       double resolution () const

   AdditionalInheritedMembers