Search results for "Silicate"
showing 10 items of 413 documents
Transport of Mobile Particles in an Immobile Environment: Computer Simulations of Sodium Silicates
2007
Molecular dynamics (MD) simulations of various sodium silicate melts, (Na2O)x(SiO2) with x=2, 3, 20, are presented. In these systems, the mobility of sodium ions is much higher, often by orders of magnitude, than that of the silicon and oxygen atoms forming a tetrahedral network structure. We show that the high mobility of sodium is intimately related to the chemical ordering in sodium silicates. A network of percolating sodium-rich channels is formed in the static structure that serve as diffusion channels for the sodium ions. This channel network is revealed in static structure factors by a prepeak at the wavenumber q=0.95 A-1. Inelastic neutron scattering experiments of sodium silicate m…
Lithium silicate admixture in mortars to be used as putty for limestone
2018
Marble is a very common material in artworks for its softness, relative isotropy and homogeneity and its characteristic waxy look that gives "life" to sculptures. Even if in geology the term "marble" refers to metamorphosed limestone, commonly the term ‘marble’ is used more broadly encompassing hard unmetamorphosed limestone that can be polished assuming a glossy aspect. In the restoration field when marble artworks have cracks that alter the smoothness of their surface, a putty is used to fill them, for both aesthetic and conservative reasons. Putties usually consist of epoxy resin mixed with marble powder. The use of a synthetic resin raises some doubts on compatibility and durability of …
Silicate and Hydroxide Concentration Influencing the Properties of Composite Al2O3-TiO2 PEO Coatings on AA7075 Alloy
2021
This work evaluates the effect of sodium meta-silicate pentahydrate (SMS) and potassium hydroxide concentrations on properties of Al2O3-TiO2 coatings produced through plasma electrolytic oxidation in a solution containing 3 g L−1 potassium titanyl oxalate, (PTO), using a unipolar waveform with constant current density. The surface and cross-section characteristics of PEO coatings including morphology, elemental distribution, and phase composition were evaluated using FESEM, EDS, and XRD techniques. Voltage-time response indicated the concentration of SMS and KOH had a significant effect on the duration of each stage of the PEO process. More cracks and pores were formed at the higher concent…
Control of the pore wall thickness and thermal stability in low-cost bimodal porous silicas
2019
Abstract A new hierarchical bimodal mesoporous silica, labelled as UVM-12 (acronym of University of Valencia Materials), has been prepared by using a solution of sodium silicate as low-cost silicon source. The final self-assembling between cationic micelles of CTAB and anionic inorganic Si-based oligomers occurs in a homogeneous aqueous medium. The reaction is carried out from low-sized building blocks through a bottom-up approach. The UVM-12 solids combine two mesopore systems according to N2 adsorption–desorption isotherms, what is corroborated by TEM micrographs and XRD patterns. This material has been inorganically modified by incorporation of Al or Ti (M-UVM-12, M = Al, Ti) without alt…
Al-27 and Si-29 Solid-State NMR Characterization of Calcium-Aluminosilicate-Hydrate
2012
International audience; Calcium silicate hydrate (C-S-H) is the main constituent of hydrated cement paste and determines its cohesive properties. Because of the environmental impact of cement industry, it is more and more common to replace a part of the clinker in cement by secondary cementitious materials (SCMs). These SCMs are generally alumina-rich and as a consequence some aluminum is incorporated into the C-S-H. This may have consequences on the cohesion and durability of the material, and it is thus of importance to know the amount and the location of Al in C-S-H and what the parameters are that control these features. The present paper reports the Si-29 and Al-27 MAS NMR analyses of …
Modular Metal Chalcogenide Chemistry: Secondary Building Blocks as a Basis of the Silicate-Type Framework Structure of CsLiU(PS4)2
2011
The novel uranium thiophosphate CsLiU(PS4)2 has been synthesized by reacting uranium metal, Cs2S, Li2S, S, and P2S5 at 700 °C in an evacuated silica tube. The crystal structure was determined by single-crystal X-ray diffraction techniques. CsLiU(PS4)2 crystallizes in the rhombohedral space group Rc (a = 15.2797(7) A; c = 28.778(2) A, V = 5818.7(5) A3, Z = 18). The structure ofCsLiU(PS4)2 is a unique three-dimensional U(PS4)22– framework with large tunnels with an approximate diameter of 6.6 A running parallel to the crystallographic c axis. The tunnels are filled with Cs+ cations. The smaller Li+ cations are located at tetrahedral sites at the periphery of the channels. In the structure of …
First Evidence of Tris(catecholato)silicate Formation from Hydrolysis of an Alkyl Bis(catecholato)silicate
2022
The hydrolysis of 3-ammoniumpropylbis(catecholato)silicate 1, giving two different silica-based materials containing different amounts of tris(catecholato)silicate, is reported. The latter species can be formed through an attack of catechol to the silicon atom in the pentacoordinate complex, in which the silicon-carbon bond is further activated toward electrophilic proton cleavage. The Knoevenagel reaction was used as a probe in order to test the availability of functional groups on the surface of such materials.
Structural and dynamical properties of sodium silicate melts: An investigation by molecular dynamics computer simulation
2001
We present the results of large scale computer simulations in which we investigate the static and dynamic properties of sodium disilicate and sodium trisilicate melts. We study in detail the static properties of these systems, namely the coordination numbers, the temperature dependence of the Q^(n) species and the static structure factor, and compare them with experiments. We show that the structure is described by a partially destroyed tetrahedral SiO_4 network and the homogeneously distributed sodium atoms which are surrounded on average by 16 silicon and other sodium atoms as nearest neighbors. We compare the diffusion of the ions in the sodium silicate systems with that in pure silica a…
The structure and stoichiometry of C-S-H
2004
Abstract This review relates to the models describing the structural evolution of calcium silicate hydrate (C-S-H) at the crystal–chemical level as a function of composition in terms of calcium to silicon ratio. The different models are compared and discussed in the light of recent spectroscopic and microscopic data. Taking into account the structure and the morphological properties of C-S-H, a surface reaction thermodynamic model has been proposed and discussed to predict and correlate the chemical and structural evolution of C-S-H with solution chemistry.
Nano- to Global-Scale Uncertainties in Terrestrial Enhanced Weathering.
2022
Enhanced weathering (EW) is one of the most promising negative emissions technologies urgently needed to limit global warming to at least below 2 °C, a goal recently reaffirmed at the UN Global Climate Change conference (i.e., COP26). EW relies on the accelerated dissolution of crushed silicate rocks applied to soils and is considered a sustainable solution requiring limited technology. While EW has a high theoretical potential of sequestering CO2, research is still needed to provide accurate estimates of carbon (C) sequestration when applying different silicate materials across distinct climates and major soil types in combination with a variety of plants. Here we elaborate on fundamental …