MolSSI Integral Reference Project
Namespaces | Functions
reffile_io.hpp File Reference

Helper functions for reading/writing reference data files. More...

#include "mirp_bin/data_entry.hpp"
#include <iostream>
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Namespaces

 mirp
 

Functions

double mirp::read_hexdouble (std::istream &fs)
 Reads a double precision number from an ASCII file. More...
 
void mirp::write_hexdouble (double d, std::ostream &fs)
 Writes a double precision number as a hexfloat to an ASCII file. More...
 
void mirp::reffile_write_basis (const std::vector< gaussian_shell > &shells, std::ostream &fs)
 Write basis information to a file. More...
 
std::vector< gaussian_shell > mirp::reffile_read_basis (std::istream &fs)
 Reads basis information from a reference file. More...
 

Detailed Description

Helper functions for reading/writing reference data files.