Gromacs
2026.0-dev-20241204-d69d709
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#include <array>
#include <string>
#include <vector>
Declares helper functions for reading structure factors from datafile.
Classes | |
struct | gmx::CromerMannParameters |
Cromer-Mann scattering factor parameters to compute structure factor dependent on Q. More... | |
struct | gmx::AtomicStructureFactor |
Neutron scattering factor parameters for an atom type. More... | |
Functions | |
std::vector < AtomicStructureFactor > | gmx::readAtomicStructureFactors () |
Helper function to read in atomic scattering data from file. | |