sc::SOTransform(3) MPQC sc::SOTransform(3) NAME sc::SOTransform - SOTransform maintains a list of AO shells that are be used to compute the SO. SYNOPSIS #include <sobasis.h> Public Member Functions void set_naoshell (int n) void add_transform (int aoshell, int irrep, double coef, int aofunc, int sofunc) Adds another term to the transform. Public Attributes int naoshell_allocated int naoshell The number of AO shells that make up this SO shell. SOTransformShell * aoshell The SOTransformShell object for each AO. Detailed Description SOTransform maintains a list of AO shells that are be used to compute the SO. The information is stored in objects of type SOTransformShell. Author Generated automatically by Doxygen for MPQC from the source code. Version 2.3.1 Thu Sep 3 2026 sc::SOTransform(3)
Want to link to this manual page? Use this URL:
<https://man.FreeBSD.org/cgi/man.cgi?query=sc_SOTransform&sektion=3&manpath=FreeBSD+Ports+15.1.quarterly>