ElementUtils.hpp

// Reaktoro is a unified framework for modeling chemically reactive systems.
//
// Copyright (C) 2014-2018 Allan Leal
//
// This library is free software; you can redistribute it and/or
// modify it under the terms of the GNU Lesser General Public
// License as published by the Free Software Foundation; either
// version 2.1 of the License, or (at your option) any later version.
//
// This library is distributed in the hope that it will be useful,
// but WITHOUT ANY WARRANTY; without even the implied warranty of
// MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU
// Lesser General Public License for more details.
//
// You should have received a copy of the GNU Lesser General Public License
// along with this library. If not, see <http://www.gnu.org/licenses/>.
 
#pragma once
 
// C++ includes
#include <string>
#include <vector>
#include <map>
 
namespace Reaktoro {
 
auto elements() -> std::vector<std::string>;
 
auto elements(std::string formula) -> std::map<std::string, double>;
 
auto atomicMass(std::string element) -> double;
 
auto molarMass(const std::map<std::string, double>& compound) -> double;
 
auto molarMass(std::string formula) -> double;
 
auto charge(const std::string& formula) -> double;
 
} // namespace Reaktoro