RASPA3 3.0.12
A molecular simulation code for computing adsorption and diffusion in nanoporous materials
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SampleMovie Struct Referenceexport

Public Member Functions

 SampleMovie (std::size_t systemId, std::size_t sampleEvery)
 
void update (const ForceField &forceField, std::size_t systemId, const SimulationBox simulationBox, const std::span< Atom > atomPositions, std::size_t currentCycle)
 

Public Attributes

std::uint64_t versionNumber {1}
 
std::size_t sampleEvery {10}
 
int modelNumber {1}
 

Friends

Archive< std::ofstream > & operator<< (Archive< std::ofstream > &archive, const SampleMovie &box)
 
Archive< std::ifstream > & operator>> (Archive< std::ifstream > &archive, SampleMovie &box)
 

The documentation for this struct was generated from the following file: