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Article: Crystal indexing method using a simulated annealing algorithm with particular applications in nanocrystal research

TitleCrystal indexing method using a simulated annealing algorithm with particular applications in nanocrystal research
Authors
Issue Date1997
PublisherJohn Wiley & Sons, Inc. The Journal's web site is located at http://www3.interscience.wiley.com/cgi-bin/jhome/33822
Citation
Journal Of Computational Chemistry, 1997, v. 18 n. 2, p. 290-299 How to Cite?
AbstractThe development of a crystal indexing computer program using interplanar angles and lattice spacings is very useful, particularly in nanocrystal research by transmission electron microscopy. However, the indexing involves a large number of possible variables, which prohibits the use of simple mathematical techniques. This article is concerned with an application of a combinatorial optimization technique using the simulated annealing algorithm for solving the crystal indexing problem where traditional descent optimization cannot be used. We show that the program can unambiguously identify the Miller indices using a set of interplanar angles even for crystals with low symmetry elements. © 1997 by John Wiley & Sons, Inc.
Persistent Identifierhttp://hdl.handle.net/10722/155912
ISSN
2015 Impact Factor: 3.648
2015 SCImago Journal Rankings: 1.471
References

 

DC FieldValueLanguage
dc.contributor.authorYiu, KFCen_US
dc.contributor.authorTam, KYen_US
dc.contributor.authorTsang, SCen_US
dc.date.accessioned2012-08-08T08:38:22Z-
dc.date.available2012-08-08T08:38:22Z-
dc.date.issued1997en_US
dc.identifier.citationJournal Of Computational Chemistry, 1997, v. 18 n. 2, p. 290-299en_US
dc.identifier.issn0192-8651en_US
dc.identifier.urihttp://hdl.handle.net/10722/155912-
dc.description.abstractThe development of a crystal indexing computer program using interplanar angles and lattice spacings is very useful, particularly in nanocrystal research by transmission electron microscopy. However, the indexing involves a large number of possible variables, which prohibits the use of simple mathematical techniques. This article is concerned with an application of a combinatorial optimization technique using the simulated annealing algorithm for solving the crystal indexing problem where traditional descent optimization cannot be used. We show that the program can unambiguously identify the Miller indices using a set of interplanar angles even for crystals with low symmetry elements. © 1997 by John Wiley & Sons, Inc.en_US
dc.languageengen_US
dc.publisherJohn Wiley & Sons, Inc. The Journal's web site is located at http://www3.interscience.wiley.com/cgi-bin/jhome/33822en_US
dc.relation.ispartofJournal of Computational Chemistryen_US
dc.titleCrystal indexing method using a simulated annealing algorithm with particular applications in nanocrystal researchen_US
dc.typeArticleen_US
dc.identifier.emailYiu, KFC:cedric@hkucc.hku.hken_US
dc.identifier.authorityYiu, KFC=rp00206en_US
dc.description.naturelink_to_subscribed_fulltexten_US
dc.identifier.scopuseid_2-s2.0-5244364091en_US
dc.relation.referenceshttp://www.scopus.com/mlt/select.url?eid=2-s2.0-5244364091&selection=ref&src=s&origin=recordpageen_US
dc.identifier.volume18en_US
dc.identifier.issue2en_US
dc.identifier.spage290en_US
dc.identifier.epage299en_US
dc.publisher.placeUnited Statesen_US
dc.identifier.scopusauthoridYiu, KFC=24802813000en_US
dc.identifier.scopusauthoridTam, KY=7409837030en_US
dc.identifier.scopusauthoridTsang, SC=7102255904en_US

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