Geometric acceleration of complex chemical equilibrium calculations —performance in two- to five-component systems
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| dc.contributor.author | Roos, Willem Abraham
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| dc.contributor.author | Bogaers, Alfred E.J.
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| dc.contributor.author | Zietsman, Johannes Hendrik
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| dc.date.accessioned | 2023-10-09T12:00:43Z | |
| dc.date.available | 2023-10-09T12:00:43Z | |
| dc.date.issued | 2023-09 | |
| dc.description | DATA AVAILABILITY : Data will be made available on request. | en_US |
| dc.description.abstract | Please read abstract in the article. | en_US |
| dc.description.department | Materials Science and Metallurgical Engineering | en_US |
| dc.description.librarian | hj2023 | en_US |
| dc.description.sponsorship | Ex Mente Technologies and Glencore through their funding of the Chair in Pyrometallurgical Modelling at the University of Pretoria. | en_US |
| dc.description.uri | http://www.elsevier.com/locate/calphad | en_US |
| dc.identifier.citation | Roos, W.A., Bogaers, A.E.J. & Zietsman, J.H. 2023, 'Geometric acceleration of complex chemical equilibrium calculations —performance in two- to five-component systems', Calphad, vol. 82, art. 102584, pp. 1-15, doi : 10.1016/j.calphad.2023.102584. | en_US |
| dc.identifier.issn | 0364-5916 (print) | |
| dc.identifier.issn | 1873-2984 (online) | |
| dc.identifier.other | 10.1016/j.calphad.2023.102584 | |
| dc.identifier.uri | http://hdl.handle.net/2263/92781 | |
| dc.language.iso | en | en_US |
| dc.publisher | Elsevier | en_US |
| dc.rights | © 2023 Elsevier Ltd. All rights reserved. Notice : this is the author’s version of a work that was submitted for publication in Calphad. Changes resulting from the publishing process, such as peer review, editing, corrections, structural formatting, and other quality control mechanisms are not reflected in this document. A definitive version was subsequently published in Calphad, vol. 82, art. 102584, pp. 1-15, doi : 10.1016/j.calphad.2023.102584. | en_US |
| dc.subject | Equilibrium calculations | en_US |
| dc.subject | CALPHAD | en_US |
| dc.subject | Acceleration | en_US |
| dc.subject | Generic lever rule | en_US |
| dc.subject | Gibbs phase rule | en_US |
| dc.subject | Process models | en_US |
| dc.subject | Multiphysics models | en_US |
| dc.title | Geometric acceleration of complex chemical equilibrium calculations —performance in two- to five-component systems | en_US |
| dc.type | Preprint Article | en_US |
