utils.cpp File Reference

#include "fourdst/composition/composition.h"
#include "fourdst/composition/exceptions/exceptions_composition.h"
#include "fourdst/atomic/atomicSpecies.h"
#include "fourdst/atomic/species.h"
#include "fourdst/composition/utils.h"
#include "fourdst/logging/logging.h"
#include <numeric>
#include <ranges>
#include <vector>
#include <set>
#include <string>
#include "quill/LogMacros.h"

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Namespaces
namespace	fourdst
namespace	fourdst::composition
	Utilities and types for representing and manipulating chemical compositions.

Functions
Composition	fourdst::composition::buildCompositionFromMassFractions (const std::set< atomic::Species > &species, const std::vector< double > &massFractions)
	Build a Composition object from species in a set and their corresponding mass fractions.
Composition	fourdst::composition::buildCompositionFromMassFractions (const std::vector< atomic::Species > &species, const std::vector< double > &massFractions)
	Build a Composition object from species and their corresponding mass fractions.
Composition	fourdst::composition::buildCompositionFromMassFractions (const std::vector< std::string > &symbols, const std::vector< double > &massFractions)
	Build a Composition object from symbols and their corresponding mass fractions.
Composition	fourdst::composition::buildCompositionFromMassFractions (const std::unordered_map< atomic::Species, double > &massFractionsMap)
	Build a Composition object from a map of species to mass fractions.
Composition	fourdst::composition::buildCompositionFromMassFractions (std::map< atomic::Species, double > massFractions)
	Build a Composition object from a map of species to mass fractions.
Composition	fourdst::composition::buildCompositionFromMassFractions (std::map< std::string, double > massFractions)
	Build a Composition object from a map of species to mass fractions.
Composition	fourdst::composition::buildCompositionFromMassFractions (const std::unordered_map< std::string, double > &massFractions)
	Build a Composition object from a map of species to mass fractions.
std::optional< fourdst::atomic::Species >	fourdst::composition::getSpecies (const std::string &symbol)