journal article·2026-01Open access

Effect of the Al content and the Ca/Si ratio on the structure and reactivity of calcium aluminosilicate glasses used as model SCMs

Luis Schnürer, Henrik Eickhoff, Harald Hilbig, Alisa Machner

Abstract

Since the reactivity of SCMs is affected by different specific properties, it is crucial to understand their impact. This study, therefore, focuses on how the Al content and Ca/Si ratio affect the structure and reactivity of calcium aluminosilicate glasses. The glasses were synthesized amorphous in 2 series with Al contents ranging from 5 to 40 wt% (Ca/Si mass ratio = 1:1) and Ca/Si ratios ranging from 0.21 to 1.00 (Al 2 O 3 content = 15 wt%). Structural analysis by FTIR, 27 Al and 29 Si MAS NMR, and theoretical NBO/T calculations showed an increasing degree of polymerization with increasing Al content or decreasing Ca/Si ratio. The reactivity, examined by the R 3 test and in cement pastes, was less affected by the degree of polymerization but more by the Al content. These findings provide insights into the dependence of structure and composition on the reactivity of model SCMs that may help in the search for new SCM sources in the future. • Structural analysis of 2 series of CAS glasses with varying Al content or Ca/Si ratio • Reactivity of artificial SCMs increases with their Al content. • Ca/Si ratio seems to have a minor impact compared to Al content regarding reactivity. • Comparison of the phase assemblage in the R 3 test and cement pastes (up to one year)
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Research context

OpenAlex topics: Concrete and Cement Materials Research · Glass properties and applications · Recycling and utilization of industrial and municipal waste in materials production

SciVX discovery tags are terminology-based. OpenAlex topics are source-provided classifications.

References (100+)

Show source-provided references
1. Green house gas emissions due to concrete manufacture10.1065/lca2007.05.327 ↗
2. IEA · 2018
3. Cement
4. Favier · 2018
5. Eco-efficient cements: potential economically viable solutions for a low-CO2 cement-based materials industry10.1016/j.cemconres.2018.03.015 ↗
6. Supplementary cementitious materials10.2138/rmg.2012.74.6 ↗
7. The effects of supplementary cementitious materials (SCMs) on the residual mechanical properties of concrete after exposure to high temperatures—review10.3390/buildings13051337 ↗
8. Efficiency of mineral admixtures in mortars: quantification of the physical and chemical effects of fine admixtures in relation with compressive strength10.1016/j.cemconres.2005.07.001 ↗
9. Blastfurnace cements
10. Development of a new rapid, relevant and reliable (R3) test method to evaluate the pozzolanic reactivity of calcined kaolinitic clays10.1016/j.cemconres.2016.02.015 ↗
11. The properties of compressed earth-based (CEB) masonry blocks
12. Concrete with highly active rice husk ash10.1007/BF02835067 ↗
13. Innovation in use and research on cementitious material10.1016/j.cemconres.2007.09.025 ↗
14. Understanding the filler effect on the nucleation and growth of C-S-H10.1111/jace.13177 ↗
15. Supplementary cementitious materials10.1016/j.cemconres.2010.12.001 ↗
16. Reactivity of supplementary cementitious materials (SCMs) in cement blends10.1016/j.cemconres.2019.105799 ↗
17. Reactivity and hydration property of synthetic air quenched slag with different chemical compositions
18. Influence of supplementary cementitious material and filler fineness on their reactivity in model systems and cementitious pastes10.1617/s11527-022-01980-2 ↗
19. Solution-controlled dissolution of supplementary cementitious material glasses at pH 13: the effect of solution composition on glass dissolution rates10.1111/jace.12480 ↗
20. The effect of glass composition on the reactivity of synthetic glasses10.1111/jace.14759 ↗
21. Examining the pozzolanicity of supplementary cementitious materials using isothermal calorimetry and thermogravimetric analysis10.1016/j.cemconcomp.2017.07.009 ↗
22. Ability of the R3 test to evaluate differences in early age reactivity of 16 industrial ground granulated blast furnace slags (GGBS)10.1016/j.cemconres.2020.105998 ↗
23. Calcium silicate hydrate (II) (“C-S-H(II)”)10.1016/0008-8846(76)90031-4 ↗
24. Model structures for C-(A)-S-H(I)10.1107/S2052520614021982 ↗
25. Investigation of C-A-S-H composition, morphology and density in limestone calcined clay cement (LC3)10.1016/j.cemconres.2018.10.011 ↗
26. The nature of C-S-H in hardened cements10.1016/S0008-8846(99)00168-4 ↗
27. Phase assemblage of cement pastes with SCM at different ages10.1016/j.conbuildmat.2019.07.059 ↗
28. The AFm phase in Portland cement10.1016/j.cemconres.2006.10.010 ↗
29. The role of calcium carbonate in cement hydration10.1016/j.cemconres.2006.10.013 ↗
30. Critical assessment of rapid methods to qualify supplementary cementitious materials for use in concrete10.1016/j.cemconres.2021.106709 ↗
31. Use of treated non-ferrous metallurgical slags as supplementary cementitious materials in cementitious mixtures10.3390/app11094028 ↗
32. Investigation on phosphogypsum–steel slag–granulated blast-furnace slag–limestone cement10.1016/j.conbuildmat.2009.12.006 ↗
33. Blended cements consisting of Portland cement–slag–silica fume–metakaolin system10.1007/s10973-016-5399-5 ↗
34. Properties of different pumice grades blended with cement10.1061/(ASCE)MT.1943-5533.0001891 ↗
35. The structure of aluminosilicate glasses: high-resolution 17O and 27Al MAS and 3QMAS NMR study10.1021/jp994273w ↗
36. Al coordination and speciation in calcium aluminosilicate glasses: effects of composition determined by 27Al MQ-MAS NMR and raman spectroscopy10.1016/j.chemgeo.2006.01.019 ↗
37. Local Al site distribution in aluminosilicate glasses by 27Al MQMAS NMR10.1016/j.jnoncrysol.2006.09.035 ↗
38. Impact of Mg substitution on the structure and pozzolanic reactivity of calcium aluminosilicate (CaO-Al2O3-SiO2) glasses10.1016/j.cemconres.2020.106231 ↗
39. Structure and reactivity of synthetic CaO-Al2O3-SiO2 glasses10.1016/j.cemconres.2019.03.004 ↗
40. Fivefold-coordinated aluminum in tectosilicate glasses observed by triple quantum MAS NMR10.2138/am-2000-1031 ↗
41. High-resolution multinuclear NMR structural study of binary aluminosilicate and other related glasses10.1021/jp031348u ↗
42. Atomic coordination and the distribution of electric field gradients in amorphous solids10.1103/PhysRevB.23.2513 ↗
43. Modelling one- and two-dimensional solid-state NMR spectra10.1002/mrc.984 ↗
44. Silicon site distributions in an alkali silicate glass derived by two-dimensional 29Si nuclear magnetic resonance10.1016/S0022-3093(96)00601-1 ↗
45. C09 Committee · 2020
46. Thermogravimetric analysis
47. Marsh · 1984
48. Schnürer
49. The effect of CaO/SiO2 molar ratio of CaO-Al2O3-SiO2 glasses on their structure and reactivity in alkali activated system10.1016/j.saa.2018.01.018 ↗
50. Surface chemistry of Calcium aluminosilicate glasses10.1111/jace.13263 ↗
51. FTIR and EPR spectroscopic investigation of calcium-silicate glasses with iron and dysprosium10.1016/j.molstruc.2014.12.020 ↗
52. XPS and FT-IR investigation of silicate polymers10.1007/s10853-009-3270-9 ↗
53. Bond characterization in cementitious material binders using Fourier-transform infrared spectroscopy10.3390/app13053353 ↗
54. Infrared spectroscopy in the investigation of oxide glasses structure10.1016/S0022-2860(99)00146-5 ↗
55. Origins of anomalous mixed-alkali effects in ion-exchanged glasses
56. Characterization of the chemical structures of natural and synthetic aluminosilicate gels and sols by infrared spectroscopy10.1016/0016-7037(79)90135-2 ↗
57. The structure of alkaline earth aluminosilicate glasses as determined by vibrational spectroscopy10.1016/0022-3093(91)90152-V ↗
58. Vibrational study of the role of trivalent ions in sodium trisilicate glass10.1016/0022-3093(94)90030-2 ↗
59. Solid state 27Al NMR and FTIR study of lanthanum aluminosilicate glasses10.1016/S0022-3093(99)00555-4 ↗
60. Thermal properties, density and structure of percalcic and peraluminus CaO–Al2O3–SiO2 glasses10.1016/j.jnoncrysol.2014.12.019 ↗
61. Infra-red spectra of inorganic aluminates and characteristic vibrational frequencies of AlO4 tetrahedra and AlO6 octahedra10.1016/0584-8539(67)80100-4 ↗
62. Structure and properties of calcium aluminosilicate glasses10.1016/0022-3093(91)90468-L ↗
63. Infrared spectroscopy of sol–gel derived silica-based films: a spectra-microstructure overview10.1016/S0022-3093(02)01637-X ↗
64. Synthesis of amorphous silica and sulfonic acid functionalized silica used as reinforced phase for polymer electrolyte membrane10.1088/2043-6262/4/4/045007 ↗
65. Structures of CeO2·Al2O3·SiO2 glasses10.1016/0022-3093(96)00138-X ↗
66. FTIR spectroscopy study of the structure changes of palygorskite under heating10.1016/j.saa.2012.07.085 ↗
67. Non-bridging oxygen and high-coordinated aluminum in metaluminous and peraluminous calcium and potassium aluminosilicate glasses: high-resolution 17O and 27Al MAS NMR results10.2138/am.2011.3680 ↗
68. High-resolution 23Na, 27Al and 29Si NMR spectroscopy of framework aluminosilicate glasses10.1016/0016-7037(87)90269-9 ↗
69. Glass structure of industrial ground granulated blast furnace slags (GGBS) investigated by time-resolved Raman and NMR spectroscopies10.1007/s10853-021-06446-4 ↗
70. Multinuclear solid-state NMR in silicate and zeolite chemistry10.1016/0165-9936(89)87043-8 ↗
71. Mass balance approach for thermogravimetric analysis in pozzolanic reactivity R3 test and effect of drying methods
72. Reactivity assessment of modified ferro silicate slag by R3 method10.3390/app11010366 ↗
73. The charge-balancing role of calcium and alkali ions in per-alkaline aluminosilicate glasses10.1021/acs.jpcb.7b12437 ↗
74. Striking role of non-bridging oxygen on glass transition temperature of calcium aluminosilicate glass-formers10.1063/1.4882283 ↗
75. On the glass present in low-calcium and in high-calcium flyashes10.1016/0008-8846(83)90002-9 ↗
76. Thermoluminescence characteristics of natural quartz and synthesized silica glass prepared by sol-gel technique10.9734/AJOPACS/2017/36403 ↗
77. The glassy structure of reactive supplementary cementitious materials (SCMs) and recycled glass: contribution of XRD and Raman spectroscopy to their characterization10.1016/j.cemconres.2024.107468 ↗
78. Investigations of thermal stability and spectroscopic features of Sm3+ doped strontium aluminate glasses
79. Viscosity of ash particles in combustion systems for prediction of particle sticking10.1021/ef00050a010 ↗
80. Molecular dynamics study of the structural properties of calcium aluminosilicate slags with varying Al2O3/SiO2 ratios10.2355/isijinternational.52.342 ↗
81. Glasses: aluminosilicates
82. A high-resolution 29Si and 27Al NMR study of alkaline earth aluminosilicate glasses10.1016/0022-3093(90)90263-L ↗
83. Bonding preferences of non-bridging O atoms: evidence from 17 O MAS and 3QMAS NMR on calcium aluminate and low-silica Ca-aluminosilicate glasses10.2138/am-2003-0701 ↗
84. The degree of aluminum avoidance in aluminosilicate glasses10.2138/am-1999-5-630 ↗
85. Evidence of intermediate-range order heterogeneity in calcium aluminosilicate glasses10.1021/cm1011795 ↗
86. Structure of calcium aluminosilicate glasses: wide-angle X-ray scattering and computer simulation10.1016/0022-3093(91)90115-M ↗
87. The distribution of aluminum in the tetrahedra of silicates and aluminates
88. Disorder and the extent of polymerization in calcium silicate and aluminosilicate glasses: O-17 NMR results and quantum chemical molecular orbital calculations10.1016/j.gca.2006.06.1550 ↗
89. Addition of low reactive clay into metakaolin-based geopolymer formulation: synthesis, existence domains and properties10.1016/j.powtec.2015.11.012 ↗
90. Alumino-silicate structural formation during alkali-activation of metakaolin: in-situ and ex-situ ATR-FTIR studies
91. Thermodynamic properties of C-S-H, C-A-S-H and M-S-H phases: results from direct measurements and predictive modelling10.1016/j.apgeochem.2018.03.004 ↗
92. Cemdata18: a chemical thermodynamic database for hydrated Portland cements and alkali-activated materials10.1016/j.cemconres.2018.04.018 ↗
93. A new approach in quantitative in-situ XRD of cement pastes: correlation of heat flow curves with early hydration reactions10.1016/j.cemconres.2010.09.014 ↗
94. Predicting the degree of reaction of supplementary cementitious materials in cementitious pastes using a pozzolanic test10.1016/j.conbuildmat.2019.01.173 ↗
95. Thermodynamic properties of Portland cement hydrates in the system CaO–Al2O3–SiO2–CaSO4–CaCO3–H2O10.1016/j.cemconres.2007.06.002 ↗
96. A critical review of the role of ettringite in binders composed of CAC–PC–C$ and CSA–PC–C$10.1111/jace.19014 ↗
97. Thermodynamic model for ternary OPC/CAC/calcium sulfate binders10.1016/j.conbuildmat.2021.124120 ↗
98. Studies on the carboaluminate formation in limestone filler-blended cements10.1016/S0008-8846(01)00491-4 ↗
99. Temperature dependence, 0 to 40 °C, of the mineralogy of Portland cement paste in the presence of calcium carbonate10.1016/j.cemconres.2009.11.010 ↗
100. Effects of the chemical composition of synthetic slags compared to an average blast furnace slag10.1002/cepa.2933 ↗