The Library
Developments in genetic algorithm techniques for structure solution from powder diffraction data
Tools
Harris, K. D. M., Habershon, Scott, Cheung, E. Y. and Johnston, R. L. (2004) Developments in genetic algorithm techniques for structure solution from powder diffraction data. Zeitschrift für Kristallographie - Crystalline Materials, Vol. 219 (No. 12). pp. 838-846. doi:10.1524/zkri.219.12.838.55856
Research output not available from this repository.
Request-a-Copy directly from author or use local Library Get it For Me service.
Official URL: http://dx.doi.org/10.1524/zkri.219.12.838.55856
Abstract
This paper presents an overview of developments that have taken place in recent years in the genetic algorithm technique for structure solution from powder diffraction data. After a brief resume of the essential features of the genetic algorithm technique for structure solution, the paper highlights recent developments in fundamental aspects of the technique, including the development of parallel computing concepts, the analysis of the evolutionary history in genetic algorithm structure solution calculations and the combination of energy information together with the powder diffraction data in structure solution. Several examples are also given to illustrate the application of the genetic algorithm technique to solve crystal structures of different types of organic molecular materials, including oligopeptides and multi-component co-crystals.
Item Type: | Journal Article | ||||
---|---|---|---|---|---|
Divisions: | Faculty of Science, Engineering and Medicine > Science > Chemistry | ||||
Journal or Publication Title: | Zeitschrift für Kristallographie - Crystalline Materials | ||||
Publisher: | Oldenbourg Wissenschaftsverlag GmbH | ||||
Official Date: | 2004 | ||||
Dates: |
|
||||
Volume: | Vol. 219 | ||||
Number: | No. 12 | ||||
Page Range: | pp. 838-846 | ||||
DOI: | 10.1524/zkri.219.12.838.55856 | ||||
Status: | Peer Reviewed | ||||
Publication Status: | Published |
Request changes or add full text files to a record
Repository staff actions (login required)
View Item |