4.3 Article

Efficient data reduction for time-of-flight neutron scattering experiments on single crystals

期刊

JOURNAL OF APPLIED CRYSTALLOGRAPHY
卷 55, 期 -, 页码 1514-1527

出版社

INT UNION CRYSTALLOGRAPHY
DOI: 10.1107/S1600576722009645

关键词

time-of-flight neutron scattering; algorithms; single crystals

资金

  1. Office of Basic Energy Sciences (BES), Division of Materials Sciences and Engineering, US DOE [DE-SC0012704]

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This paper presents a statistically correct method for adding and histogramming data for single-crystal time-of-flight neutron scattering measurements, with a focus on improving efficiency.
Event-mode data collection presents remarkable new opportunities for time-of-flight neutron scattering studies of collective excitations, diffuse scattering from short-range atomic and magnetic structures, and neutron crystallography. In these experiments, large volumes of the reciprocal space are surveyed, often using different wavelengths and counting times. These data then have to be added together, with accurate propagation of the counting errors. This paper presents a statistically correct way of adding and histogramming the data for single-crystal time-of-flight neutron scattering measurements. In order to gain a broader community acceptance, particular attention is given to improving the efficiency of calculations.

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