Neutron Scattering Data Analysis 1990, Proceedings of the Conference on Neutron Scattering, 14-16 March 1990, Rutherford Appleton Laboratory, UKM. W. Johnson |
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Page 177
... ( McGreevy and Pusztai ( 1990 ) ) and the resulting structure then used as the starting point for mod- elling the total structure factor of ZnCl2 glass ( no isotopic substitution ) ( Pusztai and McGreevy ( 1990 ) ) . Since the structures ...
... ( McGreevy and Pusztai ( 1990 ) ) and the resulting structure then used as the starting point for mod- elling the total structure factor of ZnCl2 glass ( no isotopic substitution ) ( Pusztai and McGreevy ( 1990 ) ) . Since the structures ...
Page 180
... McGreevy and Hayes ( 1990 ) ; Keen , Hayes , McGreevy and Clausen ( 1990 ) ) . Rather than a conventional crystallographic analysis of Bragg peaks RMC is used to analyse the total structure factor , i.e. Bragg and diffuse scattering ...
... McGreevy and Hayes ( 1990 ) ; Keen , Hayes , McGreevy and Clausen ( 1990 ) ) . Rather than a conventional crystallographic analysis of Bragg peaks RMC is used to analyse the total structure factor , i.e. Bragg and diffuse scattering ...
Page 183
... McGreevy ( 1990 ) ) Molten salts ( McGreevy and Pusztai ( 1990 ) ) Liquid CuSe ( Howe ( 1989 ) ) Liquid halogens ( Howe ( 1990a ) ) NiCl2 solution ( Howe ( 1990b ) ) 9. Conclusions RMC is a powerful method for producing structural ...
... McGreevy ( 1990 ) ) Molten salts ( McGreevy and Pusztai ( 1990 ) ) Liquid CuSe ( Howe ( 1989 ) ) Liquid halogens ( Howe ( 1990a ) ) NiCl2 solution ( Howe ( 1990b ) ) 9. Conclusions RMC is a powerful method for producing structural ...
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Acta Cryst algorithm applications approach atoms Bayesian beam Bragg peaks calculated configuration constraints coordinates corresponding cost function cross-section crystallographic Data Anal data analysis data set defined determined diffraction data diffractometer elastic scattering energy error bars example experiment experimental Figure Fourier transform Gaussian GENIE GENIE-V3 histogram inelastic instrument intensity interpolation inverse ISIS likelihood function magnetic structure matrix MaxEnt Reconstruction Maximum Entropy McGreevy measured method molecular Momentum Transfer MoO3 neutron diffraction neutron scattering normalisation normalization obtained optimisation optimization problems parameters Patterson map performed Phys plot positive powder diffraction presented at Neutron prior probability procedure Qmaz quasielastic refinement reflectivity data resolution function ROTAX Rutherford Appleton Laboratory sample scan Scatt scattering law shown simulated annealing single crystal solution spectra spectrometer spectrum statistical structure factor symmetry temperature time-of-flight truncation UNIRAS unit cell vanadium vector wavelength workspace