Rietveld refinement of AgCa10(PO4)7 from X-ray powder data

IN THIS ISSUE Rietveld Refinement from Powder Diffraction Data

CPD chairman’s message, Paolo Scardi 2 CPD projects: 2 Quantitative Phase Analysis RR, Ian Madsen Editor’s message, Robert Dinnebier 2 Thirty five years ago, Hugo Rietveld 3 WWW sites related to Powder Diffraction 5 IUCr Commission on Powder Diffraction 5 Rietveld Refinement from Powder Diffraction Data Beyond the abilities of Rietveld analysis: MEM-based pattern fitting with synchrotron X-ray ...

Automated parametric Rietveld refinement and its application to two- dimensional X-ray powder diffraction experiments

Synthesis and Rietveld crystal structure refinement of mackinawite, tetragonal FeS

Mackinawite,tetragonal FeS, has been synthesised by reacting iron with Na2S solutions. A Rietveld structure refinement of X-ray powder diffractipn data, recorded using X-rays monochromated from synchrotron radiationwith a wavelength of 0.6023 A, has been performed. The structure has been refined in the tetragonal sJ'.!lcegroup, P4/nmm, and has the following cell parameters: a = 3.6735(4), c = 5...

Rietan: a Software Package for the Rietveld Analysis and Simulation of X-ray and Neutron Diffraction Patterns

The Rietveld method of structure refinement with powder diffraction patterns was originally devised for the analysis of fixed-wavelength (angle-dispersive) neuron data [1] [2] but now constitutes a major breakthrough for the usefulness of X-ray powder data [3]. This powerful method has greatly extended the amount of structural detail which can be obtained routinely from powder diffraction patte...

Combining the Advantages of Powder X‐ray Diffraction and NMR Crystallography in Structure Determination of the Pharmaceutical Material Cimetidine Hydrochloride

We report the crystal structure of the anhydrous phase of cimetidine hydrochloride, determined directly from powder X-ray diffraction data. The material was prepared by dehydration of the readily obtained monohydrate form of cimetidine hydrochloride, the only form for which a crystal structure has previously been reported. As such, solid-state dehydration processes typically yield the product p...