MPQC 2.3.1

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sc::PsiInput Class Reference

PsiInput is a Psi input file. More...

`#include <psiinput.h>`

Inheritance diagram for sc::PsiInput:

List of all members.

## Public Member Functions

| PsiInput (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)

## Detailed Description

PsiInput is a Psi input file.

The documentation for this class was generated from the following file:

- psiinput.h