showing 10 related works from this author
Atomistic modeling of crystal structure of Ca1.67SiHx
2015
The atomic structure of calcium-silicate-hydrate (C-1.67-S-H-x) has been investigated by theoretical methods in order to establish a better insight into its structure. Three models for C-S-H all derived from tobermorite are proposed and a large number of structures were created within each model by making a random distribution of silica oligomers of different size within each structure. These structures were subjected to structural relaxation by geometry optimization and molecular dynamics steps. That resulted in a set of energies within each model. Despite an energy distribution between individual structures within each model, significant energy differences are observed between the three m…
Mesocrystalline calcium silicate hydrate: A bioinspired route toward elastic concrete materials
2017
Controlled aggregation of polymer-stabilized calcium silicate hydrate nanoparticles leads to elastic cementitious materials.
Identification of binding peptides on calcium silicate hydrate: a novel view on cement additives.
2014
Cement is the most used industrial product in the world. Although the chemical composition of the material has stayed more or less the same since its discovery by the Romans around 2000 years ago, [ 1 ] the performance has been increased by chemical additives. Spectacular buildings like the Willis Tower in Chicago, Taipei 101 or lately the over 800 m high Burj Khalifa in Dubai were realizable thanks to the development of high performance building materials. [ 2 ] Not only for such prestige objects but also in daily building processes, the trend goes towards always higher buildings because of the continued urbanization which was identifi ed already in 1982 as one of the so-called “megatrends…
Rate-limiting reaction of C 3 S hydration - A reply to the discussion “A new view on the kinetics of tricalcium silicate hydration” by E. Gartner
2018
Abstract In the case of coupled solids-solution reactions, any mean accelerating or decelerating one of the reaction, will also change the other reaction(s) in the same way, through the coupling mediated by the solution. The observation of any kinetic change by one of these means should not lead to too rapid conclusion on the limitation of kinetics and it must be done with great caution. Contrary to what Gartner mentioned, the acceleration of C3S hydration by the addition of calcium silicate hydrate seeds, is not a trivial evidence suggesting that hydration kinetics “has to be” limited by the C-S-H precipitation and that the C3S dissolution can be neglected. In our paper, efforts have been …
Hydration of alite containing aluminium
2011
Abstract The most important phase in Portland cement is tricalcium silicate, which leads during its hydration to the nucleation and growth of calcium silicate hydrate [referred to as C–S–H, (CaO)x–SiO2–(H2O)y]. The development of this hydrate around the cement grains is responsible for the setting and hardening of cement pastes. The general term for designating the tricalcium silicate in cements is alite. This name relates to all polymorphs containing various foreign ions inserted in their structure. These ions may influence the intrinsic reactivity, and once released during the dissolution, they may interact also with C–S–H. One of the most likely species to be inserted in the alite struct…
Two-Step Nucleation Process of Calcium Silicate Hydrate, the Nanobrick of Cement
2018
Despite a millennial history and the ubiquitous presence of cement in everyday life, the molecular processes underlying its hydration behavior, like the formation of calcium–silicate–hydrate (C–S–H), the binding phase of concrete, are mostly unexplored. Using time-resolved potentiometry and turbidimetry combined with dynamic light scattering, small-angle X-ray scattering, and cryo-TEM, we demonstrate C–S–H formation to proceed via a complex two-step pathway. In the first step, amorphous and dispersed spheroids are formed, whose composition is depleted in calcium compared to C–S–H and charge compensated with sodium. In the second step, these amorphous spheroids crystallize to tobermorite-typ…
A new view on the kinetics of tricalcium silicate hydration
2016
Abstract C3S hydration is an interesting example of chemical coupling between C3S dissolution, C–S–H and portlandite precipitation. It occurs because Ca2 +, OH− and silicate ions are present in C3S, in both hydration products and in the surrounding solution. Various experimental data sets reveal that the undersaturation with respect to C3S always increases when C3S hydration enters into the deceleratory phase, leading to the conclusion that C3S dissolution is at the origin of this deceleration, not C–S–H growth. In addition, as soon as portlandite precipitates, the dissolution limits the hydration already in the acceleratory hydration step. The evolution of the undersaturation cannot accoun…
Revised Atomistic Models of the Crystal Structure of C–S–H with high C/S Ratio
2016
Abstract The atomic structure of calcium-silicate-hydrate (C1.67–S–H x ) has been studied. Atomistic C–S–H models suggested in our previous study have been revised in order to perform a direct comparison of energetic stability of the different structures. An extensive set of periodic structures of C–S–H with variation of water content was created, and then optimized using molecular dynamics with reactive force field ReaxFF and quantum chemical semiempirical method PM6. All models show organization of water molecules inside the structure of C–S–H. The new geometries of C–S–H, reported in this paper, show lower relative energy with respect to the geometries from the original definition of C–S…
Study of alite containing aluminium hydration
2008
International audience
Hydration of alite containing alumimium
2009
International audience; The most important phase in cement is tricalcium silicate which leads during its hydration to the nucleation and growth of calcium silicate hydrate (referred to C-S-H (CaO)x-SiO2-(H2O)y). The development of this hydrate around the cement grains is responsible for the setting and hardening of cement pastes The general term for designating the tricalcium silicate in cements is alite. This name relates to all polymorphs containing various foreign ions inserted in their structure. These ions may influence the intrinsic reactivity and once released during the dissolution, they may interact also with C-S-H. The melt phase during clinkering is rich in aluminium and moreover…