Data-driven material screening of secondary and natural cementitious precursors

Abstract Cement production contributes to  >6% of global greenhouse gas emissions, driven by clinker’s energy-intensive production and limestone calcination. Replacing clinker with alternative substitutes is an effective decarbonization strategy. However, typical clinker substitutes—coal fly ash...

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Main Authors: Soroush Mahjoubi, Vineeth Venugopal, Ipek Bensu Manav, Hessam AzariJafari, Randolph E. Kirchain, Elsa A. Olivetti
Format: Article
Language:English
Published: Nature Portfolio 2025-05-01
Series:Communications Materials
Online Access:https://doi.org/10.1038/s43246-025-00820-4
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author Soroush Mahjoubi
Vineeth Venugopal
Ipek Bensu Manav
Hessam AzariJafari
Randolph E. Kirchain
Elsa A. Olivetti
author_facet Soroush Mahjoubi
Vineeth Venugopal
Ipek Bensu Manav
Hessam AzariJafari
Randolph E. Kirchain
Elsa A. Olivetti
author_sort Soroush Mahjoubi
collection DOAJ
description Abstract Cement production contributes to  >6% of global greenhouse gas emissions, driven by clinker’s energy-intensive production and limestone calcination. Replacing clinker with alternative substitutes is an effective decarbonization strategy. However, typical clinker substitutes—coal fly ash and ground granulated blast furnace slag—face current and future supply constraints. Here we systematically map reactivity variations and expand the repertoire of secondary and natural cementitious precursors. Large language models extract chemical compositions and material types of 14,000 materials from 88,000 academic papers. A multi-headed neural network predicts three reactivity metrics—heat release, Ca(OH)2 consumption, and bound water—based on chemical composition, median particle size, specific gravity, and amorphous/crystalline phase content, providing a unified assessment of cementitious reactivity and pozzolanicity. Subject to performance constraints, current supply allows for substituting half of global cement production with construction and demolition wastes and municipal solid waste incineration ash, reducing the global greenhouse gas emissions by 3%, equivalent to removing 260 million vehicles from the roads in the United States. Nearly 5–25% of 20 rock types, including ignimbrite, silicic tuff, pumice, shale, and rhyolite, are found to be reactive with heat release  >200 J/g. The identified natural precursors, available worldwide in seismic and rift zones, show promise as clinker substitutes.
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spelling doaj-art-ea3ba5b1728b411cb9b8881d88dabe9c2025-08-20T03:05:15ZengNature PortfolioCommunications Materials2662-44432025-05-016111110.1038/s43246-025-00820-4Data-driven material screening of secondary and natural cementitious precursorsSoroush Mahjoubi0Vineeth Venugopal1Ipek Bensu Manav2Hessam AzariJafari3Randolph E. Kirchain4Elsa A. Olivetti5Department of Materials Science and Engineering, Massachusetts Institute of TechnologyDepartment of Materials Science and Engineering, Massachusetts Institute of TechnologyDepartment of Civil and Environmental Engineering, Massachusetts Institute of TechnologyDepartment of Civil and Environmental Engineering, Massachusetts Institute of TechnologyMaterials Research Laboratory, Massachusetts Institute of TechnologyDepartment of Materials Science and Engineering, Massachusetts Institute of TechnologyAbstract Cement production contributes to  >6% of global greenhouse gas emissions, driven by clinker’s energy-intensive production and limestone calcination. Replacing clinker with alternative substitutes is an effective decarbonization strategy. However, typical clinker substitutes—coal fly ash and ground granulated blast furnace slag—face current and future supply constraints. Here we systematically map reactivity variations and expand the repertoire of secondary and natural cementitious precursors. Large language models extract chemical compositions and material types of 14,000 materials from 88,000 academic papers. A multi-headed neural network predicts three reactivity metrics—heat release, Ca(OH)2 consumption, and bound water—based on chemical composition, median particle size, specific gravity, and amorphous/crystalline phase content, providing a unified assessment of cementitious reactivity and pozzolanicity. Subject to performance constraints, current supply allows for substituting half of global cement production with construction and demolition wastes and municipal solid waste incineration ash, reducing the global greenhouse gas emissions by 3%, equivalent to removing 260 million vehicles from the roads in the United States. Nearly 5–25% of 20 rock types, including ignimbrite, silicic tuff, pumice, shale, and rhyolite, are found to be reactive with heat release  >200 J/g. The identified natural precursors, available worldwide in seismic and rift zones, show promise as clinker substitutes.https://doi.org/10.1038/s43246-025-00820-4
spellingShingle Soroush Mahjoubi
Vineeth Venugopal
Ipek Bensu Manav
Hessam AzariJafari
Randolph E. Kirchain
Elsa A. Olivetti
Data-driven material screening of secondary and natural cementitious precursors
Communications Materials
title Data-driven material screening of secondary and natural cementitious precursors
title_full Data-driven material screening of secondary and natural cementitious precursors
title_fullStr Data-driven material screening of secondary and natural cementitious precursors
title_full_unstemmed Data-driven material screening of secondary and natural cementitious precursors
title_short Data-driven material screening of secondary and natural cementitious precursors
title_sort data driven material screening of secondary and natural cementitious precursors
url https://doi.org/10.1038/s43246-025-00820-4
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