Simulations of Crystal Dissolution Using Interacting Particles: Prediction of Stress Evolution and Rates at Defects and Application to Tricalcium Silicate

2020 ◽  
Vol 124 (36) ◽  
pp. 19603-19615
Author(s):  
Kumaran Coopamootoo ◽  
Enrico Masoero
Keyword(s):  
Tricalcium Silicate ◽  
Stress Evolution ◽  
Interacting Particles ◽  
Crystal Dissolution

scholarly journals KINETIC BEHAVIOR OF THE INTERACTION BETWEEN TRICALCIUM SILICATE AND LIQUID PHASE

2019 ◽  
pp. 140-149
Author(s):  
Yu. S. Sarkisov ◽  
D. A. Afanasyev
Keyword(s):  
Liquid Phase ◽  
Tricalcium Silicate ◽  
Static Model ◽  
Radical Reactions ◽  
Ionic Mechanism ◽  
Particle Charge ◽  
Kinetic Behavior ◽  
Interacting Particles ◽  
Spin Direction ◽  
2D Simulation

This paper presents a 2D-simulation of the main stages of the tricalcium silicate hardening which reflects a possible mechanism of radical reactions with regard to the spin state of the interacting particles. The principles of the universal static model are used for 2D-simulation. It is shown that the particle charge determines the ionic mechanism. In this case, the electron spin direction does not affect the reaction process. It is demonstrated that the spin direction is important for the interacting particles.

Solvation and redox properties of [Co(en)3]3+-[Co(en)3]2+ system

1980 ◽  
Vol 45 (2) ◽  
pp. 335-338 ◽  
Author(s):  
Adéla Kotočová ◽  
Ulrich Mayer
Keyword(s):  
Hydrogen Bond ◽  
Lewis Acid ◽  
Specific Interaction ◽  
Redox Properties ◽  
Solvation Effect ◽  
Interacting Particles ◽  
Acid Base ◽  
Polar Solvents ◽  
Oxidation Reduction ◽  
Solvent Molecules

The solvation effect of a number of nonaqueous polar solvents was studied on the oxidation-reduction properties of the [Co(en)3]3+-[Co(en)3]2+ system. Interactions of these ions with the solvent molecules are discussed in terms of their coordination, which is accompanied by a specific interaction of the Lewis acid-base type, namely formation of a hydrogen bond between the interacting particles. This is the main controlling factor of the redox properties of the studied system.

Effect of grain size on the vapour phase hydration of monoclinic and triclinic modifications of tricalcium silicate; role of high temperature activation

1991 ◽  
Vol 56 (10) ◽  
pp. 1993-2008
Author(s):  
S. Hanafi ◽  
G. M. S. El-Shafei ◽  
B. Abd El-Hamid
Keyword(s):  
Particle Size ◽  
Vapour Phase ◽  
Tricalcium Silicate ◽  
Active Centers ◽  
Thermally Activated ◽  
Grain Sizes ◽  
Intermediate Size ◽  
Surface Active ◽  
Temperature Activation

The hydration of tricalcium silicate (C3S) with three grain sizes of monoclinic (M) and triclinic (T) modifications and on their thermally activated samples were investigated by exposure to water vapour at 80°C for 60 days. The products were investigated by XRD, TG and N2 adsorption. The smaller the particle size the greater was the hydration for both dried and activated samples from (M). In the activated samples a hydrate with 2θ values of 38.4°, 44.6° and 48.6° could be identified. Hydration increased with particle size for the unactivated (T) samples but after activation the intermediate size exhibited enhanced hydration. Thermal treatment at 950°C of (T) samples increased the surface active centers on the expense of those in the bulk. Changes produced in surface texture upon activation and/or hydration are discussed.

Investigation on a New Hydraulic Cementitious Binder Made from Phosphogypsum

2013 ◽  
Vol 864-867 ◽  
pp. 1923-1928
Author(s):  
Yue Xu ◽  
Jian Xi Li ◽  
Li Li Kan
Keyword(s):  
Compressive Strength ◽  
Fly Ash ◽  
Active Carbon ◽  
High Strength ◽  
Tricalcium Silicate ◽  
Dicalcium Silicate ◽  
Cementitious Material ◽  
Saturation Ratio ◽  
Tricalcium Aluminate ◽  
Cementitious Binder

A new kind of high strength cementitious material is made from phosphogypsum (PG), active carbon and fly-ash. Through the orthogonal research, it was showed that the calcination temperature, retention time, dosage of active carbon and fly ash on the compressive strength of cementitious binder are the most important. The result also showed that, in the conditions of temperature 1200°C, time retention 30 min, dosage of active carbon 10%, dosage of fly ash 5%, the compressive strength of the cementitious material for 3d and 28d could reach to 46.35MPa and 92.70MPa, the content of sulfur trioxide was 11.60% accordingly. A lot of active mineral materials, such as dicalcium silicate, tricalcium silicate, tricalcium aluminate were formed in the calcination. The C-S-H gel, calcium hydroxide and ettringite were found in 3d and 28d hydrates. It is found that the lime saturation ratio and silica modulus need to be control between 0.40~0.65 and 4~8 in order to produce high strength cementitious material.

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