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“Powder 3D Parametric”- A program for Automated Sequential and Parametric Rietveld Refinement Using Topas

Journal Materials Science Forum (Volume 651)
Volume Extending the Reach of Powder Diffraction Modelling
Edited by Paolo Scardi and Robert E. Dinnebier
Pages 97-104
DOI 10.4028/www.scientific.net/MSF.651.97
Citation Paneerselvam Rajiv et al., 2010, Materials Science Forum, 651, 97
Online since May, 2010
Authors Paneerselvam Rajiv, Robert E. Dinnebier, Martin Jansen
Keywords In Situ Powder Diffraction, Automation, Avrami, Parametric Refinement, Rietveld, Sequential Refinement, Time-Resolved, TOPAS
Abstract

A new program to perform fast sequential and parametric whole powder profile refinement of in situ time-resolved powder diffraction data is presented. The program interacts with the launch mode kernel of the total powder pattern analysis software suite Topas® for doing the refinements. The program provides a graphical interface platform, upon which the huge Topas input command files necessary to perform sequential and parametric refinements can be easily prepared and executed. This program requires the user license dongle for Topas academic version 3 or higher.

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