sc::PsiInput - PsiInput is a Psi input file.

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

PsiInput is a Psi input file.

       sc::PsiInput - PsiInput is a Psi input file.

       #include <psiinput.h>

       Inherits sc::RefCount.

   PublicMemberFunctionsPsiInput (const string &name)
       void open ()
       void close ()
       void print (std::ostream &)
       void begin_section (const char *s)
       void end_section ()
       void write_indent ()
       void incindent (int)
       void decindent (int)
       void write_comment (const char *)
       void write_keyword (const char *, const char *)
       void write_keyword (const char *, int)
       void write_keyword (const char *, double)
       void write_keyword_array (const char *, int, int *)
       void write_keyword_array (const char *, int, double *)
       void write_string (const char *)
       void write_key_wq (const char *, const char *)
       void write_basis (const Ref< GaussianBasisSet > &)
           Construct the 'basis' keyword for input.
       void write_basis_sets (const Ref< GaussianBasisSet > &)
           Write basis sets explicitly.
       void write_geom (const Ref< Molecule > &)
       void write_defaults (const Ref< PsiExEnv > &, const char *dertype)

   AdditionalInheritedMembers