Gromacs  2024.2
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Classes | Functions
#include <array>
#include <string>
#include <vector>
+ Include dependency graph for scatteringfactors.h:
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Description

Declares helper functions for reading structure factors from datafile.

Author
Alexey Shvetsov alexx.nosp@m.yum@.nosp@m.gmail.nosp@m..com

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.