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Acta Cryst alloys analysis antiferromagnetic approximately atoms average axis beam bond Bragg calculated Chem cluster component compounds correlation cross-section crystallographic density dependence detector determined diffractometer diffuse scattering disorder distribution elastic electron energy experimental experiments ferromagnetic Fourier function graphite hedenbergite hollandites hydrogen indicate inelastic intensity interactions ions lattice librations low temperatures magnetic diffuse magnetic field magnetic scattering Materials Science Materials Science Forum measurements metal methods molecular molecules neutron diffraction neutron powder neutron scattering nuclear observed obtained octahedral orientation oxygen parameters particles peak phase transition phonon Phys polarisation polymer positions powder diffraction precipitates reactor refinement reflections resolution room temperature rotational sample Science Forum Vols shown in figure shows single crystal small angle solid solution space group spin glass spin wave strain structure factor studies sublattice symmetry SYNROC techniques thermal tunnel unit cell vector volume fraction wavelength X-ray zeolite