gmx::AtomicStructureFactor Struct Reference

#include <gromacs/trajectoryanalysis/modules/scatteringfactors.h>

Collaboration diagram for gmx::AtomicStructureFactor:

Description

Neutron scattering factor parameters for an atom type.

Public Attributes
std::string	isotope
	atomic isotope
int	atomicNumber
	Number of Protons.
double	neutronIsotropicScatteringLength
	neutron scattering length (1e-15m)
CromerMannParameters	xrayCromerMannParameters
	Parameters for the Cromer Mann fit.

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

• src/gromacs/trajectoryanalysis/modules/scatteringfactors.h