## Neutron Scattering Data Analysis 1990: Invited and Contributed Papers from the Conference on Neutron Scattering Data Analysis Held at The Rutherford Appleton Laboratory, Chilton, 14-16 March 1990 |

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Page 84

also has an implementation of GKS, so can be used immediately for applications

already written to use GKS. However, since the GKS routines have been ...

**Figure**1 shows the relationship between the various files used by UNIRAS whichalso has an implementation of GKS, so can be used immediately for applications

already written to use GKS. However, since the GKS routines have been ...

Page 85

for MnOj, pyroluaite, (single edge sharing chains) and ramadellite, (shaded,

alternating double chains). The 7 — MnO) is thought to be an irregular

intergrowth of ...

**Figure**2. Two different arrangements of AfnOg, octahedra in two mineral formafor MnOj, pyroluaite, (single edge sharing chains) and ramadellite, (shaded,

alternating double chains). The 7 — MnO) is thought to be an irregular

intergrowth of ...

Page 88

There are 80 by 80 in

This is less than the resolution of the screens we are using, but when bigger data

sets are generated they need to be scaled with care before display if vital ...

There are 80 by 80 in

**Figure**5a, an analysed data set with some negative values.This is less than the resolution of the screens we are using, but when bigger data

sets are generated they need to be scaled with care before display if vital ...

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### Common terms and phrases

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 detector bank determined diffraction data diffractometer distribution function elastic scattering energy error bars example experiment experimental Figure Fourier transform Gaussian GENIE GENIE-V3 histogram inelastic instrument intensity inverse ISIS least squares likelihood function magnetic structure magnetisation density matrix MaxEnt reconstruction Maximum Entropy McGreevy measured method molecular Monte Carlo neutron diffraction neutron scattering normalisation normalization obtained optimisation optimization problems parameters Patterson map performed Phys plot positive powder diffraction presented at Neutron prior procedure quasielastic radial distribution functions refinement reflectivity data resolution function ROTAX Rutherford Appleton Laboratory sample scan scattering law shown simulated annealing single crystal solution spectra spectrometer spectrum statistical structure factor symmetry technique temperature time-of-flight truncation UNIRAS unit cell vanadium vector wavelength workspace