Nanoscale texture development of C-S-H gel: A computational model for nucleation and growth

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dc.contributor.authorGonzález-Teresa, R.
dc.contributor.authorDolado, J. S.
dc.contributor.authorAyuela, A.
dc.contributor.authorGimel, Jean Christophe
dc.contributor.institutionTecnalia Research & Innovation
dc.date.accessioned2024-07-24T12:00:58Z
dc.date.available2024-07-24T12:00:58Z
dc.date.issued2013-12-02
dc.description.abstractThe development of C-S-H (Calcium-Silicate-Hydrate) gels during cement hydration is often investigated by nucleation and growth models which fit reasonably well with the calorimetric measurements but predict hydration degrees which grossly exceed the experimental values. Here, a computational model is presented which explicitly considers the intrinsic nanoparticulate nature of C-S-H gel. Based on a nucleation and growth algorithm the model reproduces the experimental calorimetric and hydration degree measurements without invoking to any diffusion mechanism. The model also suggests that the peak in the calorimetric curves can be ascribed to the percolation point of the hydrates themselves within the interstitial pore volume.en
dc.description.sponsorshipThis study was carried out under the umbrella of the BASKRETE initiative and supported by funding from the Basque Government through the Nanoiker project (Grant No. E11-304) under the ETORTEK Program, the FP7 program of the European Commission (CODICE project—Contract NMP3-SL-2008-214030), the Spanish Ministerio de Ciencia y Tecnologia of Spain (Grant Nos. TEC2007-68065-C03-03 and FIS2010-19609-C02-02), and the University of the Basque Country (Grant No. IT-366-07). R.G.-T. acknowledges the hospitality of the Donostia International Physics Center (DIPC). The computing facilities of TECNALIA, DIPC, and the Supercomputing Center of Galicia CESGA are acknowledged. We would also like to thank Professor M. J. Stott for carefully reading our manuscript and for giving such constructive comments, which help us to improve the manuscript.
dc.description.statusPeer reviewed
dc.identifier.citationGonzález-Teresa , R , Dolado , J S , Ayuela , A & Gimel , J C 2013 , ' Nanoscale texture development of C-S-H gel : A computational model for nucleation and growth ' , Applied Physics Letters , vol. 103 , no. 23 , 234105 . https://doi.org/10.1063/1.4838396
dc.identifier.doi10.1063/1.4838396
dc.identifier.issn0003-6951
dc.identifier.urihttps://hdl.handle.net/11556/3095
dc.identifier.urlhttp://www.scopus.com/inward/record.url?scp=84889794106&partnerID=8YFLogxK
dc.language.isoeng
dc.relation.ispartofApplied Physics Letters
dc.relation.projectIDFP7 program of the European Commission, NMP3-SL-2008-214030
dc.relation.projectIDSpanish Ministerio de Ciencia y Tecnologia of Spain, TEC2007-68065-C03-03-FIS2010-19609-C02-02
dc.relation.projectIDSeventh Framework Programme, FP7, 214030
dc.relation.projectIDEusko Jaurlaritza, E11-304
dc.relation.projectIDEuskal Herriko Unibertsitatea, EHU
dc.rightsinfo:eu-repo/semantics/openAccess
dc.subject.keywordsPhysics and Astronomy (miscellaneous)
dc.titleNanoscale texture development of C-S-H gel: A computational model for nucleation and growthen
dc.typejournal article
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