/*************************************************************************************
* *
* ***** OpenThermo ***** *
* Calculation of thermodynamic functions from molecular data *
* Copyright 2008 Konstantin Tokarev <annulen@users.sourceforge.net> *
* and others *
* *
*************************************************************************************
* *
* This program is free software; you can redistribute it and/or modify *
* it under the terms of the GNU General Public License. See COPYING for *
* more details *
* *
*************************************************************************************
* Module name : input.hpp *
* Author : Tokarev. K *
* Last modification : 2009/03/13 *
* Description : Header for input.cpp *
* *
*************************************************************************************/
#ifndef KERNEL_HPP
#define KERNEL_HPP
#include "molecule.hpp"
#include "xml.hpp"
bool Initial (Molecule * M, const char * LogName);
double lnZ (double T, double V, double & ZPVE, ostream & flog);
void Thermo (double T, double p, double & ZPVE, ostream & flog, ostream & fout);
#endif /* KERNEL_HPP */