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Review of research on micromechanical properties of cement-based materials based on molecular dynamics simulation
The research on the strength, deformation and failure process of materials should be
implemented on the atomic scale to study the interaction between atoms. Molecular …
implemented on the atomic scale to study the interaction between atoms. Molecular …
Influence of the Ca/Si ratio on the compressive strength of cementitious calcium–silicate–hydrate binders
The relation between the chemical composition of calcium–silicate–hydrate (C–S–H)
phases and its influence on the compressive strength of cementitious materials is …
phases and its influence on the compressive strength of cementitious materials is …
State of the art in composition, fabrication, characterization, and modeling methods of cement-based thermoelectric materials for low-temperature applications
The worldwide energy crisis and environmental deterioration are probably humanity's
greatest challenges. Thermoelectricity, which allows for the mutual conversion between …
greatest challenges. Thermoelectricity, which allows for the mutual conversion between …
Influences of cross-linking and Al incorporation on the intrinsic mechanical properties of tobermorite
Tobermorite is the model for calcium aluminosilicate hydrate (C-(A-) SH), the glue in
concrete, and is also the binding phase in cement-based materials under geological …
concrete, and is also the binding phase in cement-based materials under geological …
Physico-mechanical performance and durability of artificial lightweight aggregates synthesized by cementing and geopolymerization
This study encompasses production of lightweight aggregates (LWAs) through cold bonded
pelletization using two different industrial by-products; coal fly ash (FA) and ground …
pelletization using two different industrial by-products; coal fly ash (FA) and ground …
Mechanical properties of CSH globules and interfaces by molecular dynamics simulation
Abstract At meso-scale, Calcium Silicate Hydrate (CSH) can be considered as randomly
packed globules (about 4.2 nm), which forms the basic unit cell, with water molecules and …
packed globules (about 4.2 nm), which forms the basic unit cell, with water molecules and …
[HTML][HTML] Ab-initio investigation of the fundamental properties of metals (X= Be, Mg, and Ca) encapsulated CsXO3 tin-based perovskite materials
Perovskite material are widely used in Solar cell device due to it promising properties and
power conversion efficiencies (PCE). Most importantly, properties of the absorber layer such …
power conversion efficiencies (PCE). Most importantly, properties of the absorber layer such …
Mechanical and fracture properties of calcium silicate hydrate and calcium hydroxide composite from reactive molecular dynamics simulations
Y Liang - Chemical Physics Letters, 2020 - Elsevier
This paper firstly investigated the mechanical and fracture properties of calcium silicate
hydrate and calcium hydroxide composite by reactive molecular dynamics simulations. The …
hydrate and calcium hydroxide composite by reactive molecular dynamics simulations. The …
Alkali silica reaction: A view from the nanoscale
Understanding the formation of Alkali-silica reaction gel (ASR gel) and its behavior in
cement pore network solutions is the key to mitigate one of the main causes of the strength …
cement pore network solutions is the key to mitigate one of the main causes of the strength …
Nature of interatomic bonding in controlling the mechanical properties of calcium silicate hydrates
Calcium silicate hydrate (C–S–H) is the most important phase of hydrated cement gel which
is the key material in construction industry. It is well accepted that hardened cement paste …
is the key material in construction industry. It is well accepted that hardened cement paste …