A grid search procedure of positioning a known molecule in an unknown crystal structure with the use of powder diffraction data-Reference-Cited by-同舟云学术

A grid search procedure of positioning a known molecule in an unknown crystal structure with the use of powder diffraction data

Published:1998-01-01 Issue:1 Volume:213 Page:1-3
ISSN:2194-4946
Container-title:Zeitschrift für Kristallographie - Crystalline Materials
language:en
Short-container-title:

Author:

Chernyshev V. V.,Schenk H.

Abstract

Abstract An efficient grid search procedure successfully applied to the solution of three unknown molecular structures from X-ray and neutron powder diffraction data is presented.

Publisher

Walter de Gruyter GmbH

Subject

Inorganic Chemistry,Condensed Matter Physics,General Materials Science

Link

https://www.degruyter.com/document/doi/10.1524/zkri.1998.213.1.1/pdf

Reference12 articles.

1. Direct Methods and Powder Data: State of the Art and Perspectives

2. The development of Monte Carlo methods for crystal structure solution from powder diffraction data: simultaneous translation and rotation of a structural fragment within the unit cell

3. A General Monte Carlo Approach to Structure Solution from Powder Diffraction Data: Application to Poly(ethylene oxide)3:LiN(SO3CF3)2

4. Crystal structure determination from powder diffraction data by the application of a genetic algorithm

5. P-RISCON: a real-space scavenger for crystal structure determination from powder diffraction data

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