Data

Robustness of quantitative phase analysis of X-ray diffraction data by the Rietveld method – fixed zero error

Curtin University
Rowles, Matthew
Viewed: [[ro.stat.viewed]] Cited: [[ro.stat.cited]] Accessed: [[ro.stat.accessed]]
ctx_ver=Z39.88-2004&rft_val_fmt=info%3Aofi%2Ffmt%3Akev%3Amtx%3Adc&rfr_id=info%3Asid%2FANDS&rft_id=info:doi10.25917/NVSW-0044&rft.title=Robustness of quantitative phase analysis of X-ray diffraction data by the Rietveld method – fixed zero error&rft.identifier=10.25917/NVSW-0044&rft.publisher=Curtin University&rft.description=Diffraction data of varying qualities were collected in Apr and Dec 2019 and analysed by different Rietveld models over Oct 2020.The data consists of the diffraction patterns, input files for the diffraction analysis software package TOPAS, batch files for running the input files, an include file with custom macros, and the output of those refinements. A key describing the column names and filename conventions is also given. Zero error was fixed at 0. All files are in text format: Results of model refinements: 8 filesDiffraction data: 234 filesInput files: 8 filesBatch files: 8 filesInclude file: 1 file In order to run the input files, a copy of TOPAS version 6 (or greater) is required (either the Bruker version or TOPAS Academic).&rft.creator=Rowles, Matthew &rft.date=2020&rft_rights=&rft_subject=Condensed Matter Characterisation Technique Development&rft_subject=PHYSICAL SCIENCES&rft_subject=CONDENSED MATTER PHYSICS&rft_subject=030106 &rft_subject=X-ray diffraction&rft_subject=Rietveld analysis&rft_subject=quantitative phase analysis&rft_subject=robustness&rft.type=dataset&rft.language=English Access the data
Cite Saved to MyRDA Save to MyRDA

Licence & Rights:

Open Licence view details
CC-BY

Access:

Open

Full description

Diffraction data of varying qualities were collected in Apr and Dec 2019 and analysed by different Rietveld models over Oct 2020.

The data consists of the diffraction patterns, input files for the diffraction analysis software package TOPAS, batch files for running the input files, an include file with custom macros, and the output of those refinements. A key describing the column names and filename conventions is also given. Zero error was fixed at 0.

All files are in text format:

Results of model refinements: 8 files
Diffraction data: 234 files
Input files: 8 files
Batch files: 8 files
Include file: 1 file


In order to run the input files, a copy of TOPAS version 6 (or greater) is required (either the Bruker version or TOPAS Academic).

Data time period: 01 04 2019 to 31 10 2020

This dataset is part of a larger collection

Click to explore relationships graph
Help

Related Data

Related People

Subjects
030106 | Condensed Matter Physics | Condensed Matter Characterisation Technique Development | Physical Sciences | Rietveld analysis | X-ray diffraction | quantitative phase analysis | robustness |

User Contributed Tags    

Login to tag this record with meaningful keywords to make it easier to discover

Other Information
Outcomes of the International Union of Crystallography Commission on Powder Diffraction Round Robin on Qu­antitative Phase Analysis: samples 1a to 1h

doi : 10.1107/S0021889801007476

Identifiers
Similar data you may be interested in: