Function sequant::open_shell_CC_spintrace

• Defined in File spin.cpp

Function Documentation

std::vector<ExprPtr> sequant::open_shell_CC_spintrace(const ExprPtr &expr)

Transforms Coupled cluster from spin orbital to spatial orbitals.

Parameters:

expr – ExprPtr to Sum type with spin orbital indices

Returns:

a vector of spin expressions for open-shell reference