Short-range order in multicomponent materials.

The generalized multicomponent short-range order (GM-SRO) parameter has been adapted for the characterization of short-range order within the highly chemically and spatially resolved three-dimensional atomistic images provided by the microscopy technique of atom-probe tomography (APT). It is demonst...

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Main Authors: Ceguerra, A, Moody, M, Powles, R, Petersen, T, Marceau, R, Ringer, S
Format: Journal article
Language:English
Published: 2012
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author Ceguerra, A
Moody, M
Powles, R
Petersen, T
Marceau, R
Ringer, S
author_facet Ceguerra, A
Moody, M
Powles, R
Petersen, T
Marceau, R
Ringer, S
author_sort Ceguerra, A
collection OXFORD
description The generalized multicomponent short-range order (GM-SRO) parameter has been adapted for the characterization of short-range order within the highly chemically and spatially resolved three-dimensional atomistic images provided by the microscopy technique of atom-probe tomography (APT). It is demonstrated that, despite the experimental limitations of APT, in many cases the GM-SRO results derived from APT data can provide a highly representative description of the atomic scale chemical arrangement in the original specimen. Further, based upon a target set of the GM-SRO parameters, measured from APT experiments, a Monte Carlo algorithm was utilized to simulate statistically equivalent atomistic systems which, unlike APT data, are complete and lattice based. The simulations replicate solute structures that are statistically consistent with other correlation measures such as solute cluster distributions, enable more quantitative characterization of nanostructural phenomena in the original specimen and, significantly, can be incorporated directly into other models and simulations.
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spelling oxford-uuid:3398cade-0424-415d-b293-7f619957cdd22022-03-26T13:21:05ZShort-range order in multicomponent materials.Journal articlehttp://purl.org/coar/resource_type/c_dcae04bcuuid:3398cade-0424-415d-b293-7f619957cdd2EnglishSymplectic Elements at Oxford2012Ceguerra, AMoody, MPowles, RPetersen, TMarceau, RRinger, SThe generalized multicomponent short-range order (GM-SRO) parameter has been adapted for the characterization of short-range order within the highly chemically and spatially resolved three-dimensional atomistic images provided by the microscopy technique of atom-probe tomography (APT). It is demonstrated that, despite the experimental limitations of APT, in many cases the GM-SRO results derived from APT data can provide a highly representative description of the atomic scale chemical arrangement in the original specimen. Further, based upon a target set of the GM-SRO parameters, measured from APT experiments, a Monte Carlo algorithm was utilized to simulate statistically equivalent atomistic systems which, unlike APT data, are complete and lattice based. The simulations replicate solute structures that are statistically consistent with other correlation measures such as solute cluster distributions, enable more quantitative characterization of nanostructural phenomena in the original specimen and, significantly, can be incorporated directly into other models and simulations.
spellingShingle Ceguerra, A
Moody, M
Powles, R
Petersen, T
Marceau, R
Ringer, S
Short-range order in multicomponent materials.
title Short-range order in multicomponent materials.
title_full Short-range order in multicomponent materials.
title_fullStr Short-range order in multicomponent materials.
title_full_unstemmed Short-range order in multicomponent materials.
title_short Short-range order in multicomponent materials.
title_sort short range order in multicomponent materials
work_keys_str_mv AT ceguerraa shortrangeorderinmulticomponentmaterials
AT moodym shortrangeorderinmulticomponentmaterials
AT powlesr shortrangeorderinmulticomponentmaterials
AT petersent shortrangeorderinmulticomponentmaterials
AT marceaur shortrangeorderinmulticomponentmaterials
AT ringers shortrangeorderinmulticomponentmaterials