Psi4
Classes | Namespaces
IRC_data.h File Reference
#include <fstream>
#include <vector>
#include "linear_algebra.h"
#include "molecule.h"
#include "print.h"
#include "io.h"

Go to the source code of this file.

Classes

class  opt::IRC_POINT
 
class  opt::IRC_DATA
 

Namespaces

 opt
 

Detailed Description

: header for structure that holds IRC data