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Correlation between Composition and Mechanical Properties of Calcium Silicate Hydrates Identified by Infrared Spectroscopy and Density Functional Theory

Journal of physical chemistry. C, 2019-05, Vol.123 (17), p.10868-10873

2019

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COMPREHENSIVE EXAMINATION OF DEHYDROXYLATION OF KAOLINITE, DISORDERED KAOLINITE, AND DICKITE: EXPERIMENTAL STUDIES AND DENSITY FUNCTIONAL THEORY

Clays and clay minerals, 2020-08, Vol.68 (4), p.319-333

2020

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Dissolution of β-C2S Cement Clinker: Part 2 Atomistic Kinetic Monte Carlo (KMC) Upscaling Approach

Materials, 2022-09, Vol.15 (19), p.6716

2022

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3D Off-Lattice Coarse-Grained Monte Carlo Simulations for Nucleation of Alkaline Aluminosilicate Gels

Materials, 2023-02, Vol.16 (5), p.1863

2023

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Dissolution of Portlandite in Pure Water: Part 1 Molecular Dynamics (MD) Approach

Materials, 2022-02, Vol.15 (4), p.1404

2022

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Coarse-Grained Monte Carlo Simulations with Octree Cells for Geopolymer Nucleation at Different pH Values

Materials, 2023-12, Vol.17 (1), p.95

2023

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Carbon nanotubes and nanohorns in geopolymers: A study on chemical, physical and mechanical properties

Materials & design, 2024-04, Vol.240, p.112851, Article 112851

2024

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Dissolution of Portlandite in Pure Water: Part 2 Atomistic Kinetic Monte Carlo (KMC) Approach

Materials, 2022-02, Vol.15 (4), p.1442

2022

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Dissolution of β-C2S Cement Clinker: Part 1 Molecular Dynamics (MD) Approach for Different Crystal Facets

Materials, 2022-09, Vol.15 (18), p.6388

2022

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Silicate Dissolution Mechanism from Metakaolinite Using Density Functional Theory

Nanomaterials (Basel, Switzerland), 2023-03, Vol.13 (7), p.1196

2023

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Interactions between Reduced Graphene Oxide with Monomers of (Calcium) Silicate Hydrates: A First-Principles Study

Nanomaterials (Basel, Switzerland), 2021-08, Vol.11 (9), p.2248

2021

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Finite Element Analysis of Shear Reinforcing of Reinforced Concrete Beams with Carbon Fiber Reinforced Polymer Grid-Strengthened Engineering Cementitious Composite

Buildings (Basel), 2023-04, Vol.13 (4), p.1034

2023

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Correction to: Comprehensive Examination of Dehydroxylation of Kaolinite, Disordered Kaolinite, and Dickite: experimental Studies and Density Functional Theory

Clays and clay minerals, 2021, Vol.69 (2), p.299-299

2021

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Atomistic Insights into Silicate Dissolution of Metakaolinite under Alkaline Conditions: Ab Initio Quantum Mechanical Investigation

Langmuir, 2024-09, Vol.40 (37), p.19332-19342

2024

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Theoretical Elastic Constants of Tobermorite Enhanced with Reduced Graphene Oxide through Hydroxyl vs Epoxy Functionalization: A First-Principles Study

Journal of physical chemistry. C, 2023-09, Vol.127 (36), p.18117-18126

2023

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Unexpected Chemical Activity of a Mineral Surface: The Role of Crystal Water in Tobermorite

Journal of physical chemistry. C, 2022-08, Vol.126 (30), p.12405-12412

2022

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Molecular dynamics study on the crack propagation in carbon doped polycrystalline boron-nitride nanosheets

Computational materials science, 2022-02, Vol.203, p.111066, Article 111066

2022

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The effect of temperature and topological defects on fracture strength of grain boundaries in single-layer polycrystalline boron-nitride nanosheet

Computational materials science, 2016-10, Vol.123, p.277-286

2016

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Investigation of crack propagation and existing notch on the mechanical response of polycrystalline hexagonal boron-nitride nanosheets

Computational materials science, 2017-04, Vol.131, p.86-99

2017

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Molecular dynamics study on the mechanical properties of carbon doped single-layer polycrystalline boron-nitride nanosheets

Computational materials science, 2018-10, Vol.153, p.16-27

2018

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Investigation into the effect of doping of boron and nitrogen atoms in the mechanical properties of single-layer polycrystalline graphene

Computational materials science, 2017-10, Vol.138, p.435-447

2017

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Atomistic study of the effect of crystallographic orientation on the twinning and detwinning behavior of NiTi shape memory alloys

Computational materials science, 2022-02, Vol.203, p.111080, Article 111080

2022

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A quadratic piezoelectric multi-layer shell element for FE analysis of smart laminated composite plates induced by MFC actuators

Smart materials and structures, 2018-09, Vol.27 (9), p.95004

2018

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Modified calculation method of earth pressure and internal force of the abutment-pile in integral abutment jointless bridges

Archives of Civil and Mechanical Engineering, 2022-09, Vol.22 (4), p.205, Article 205

2022

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Localized failure analysis of internally pressurized laminated ellipsoidal woven GFRP composite domes: Analytical, numerical, and experimental studies

Archives of Civil and Mechanical Engineering, 2019-08, Vol.19 (4), p.1235-1250

2019

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Correlation between Composition and Mechanical Properties of Calcium Silicate Hydrates Identified by Infrared Spectroscopy and Density Functional Theory

COMPREHENSIVE EXAMINATION OF DEHYDROXYLATION OF KAOLINITE, DISORDERED KAOLINITE, AND DICKITE: EXPERIMENTAL STUDIES AND DENSITY FUNCTIONAL THEORY

Dissolution of β-C2S Cement Clinker: Part 2 Atomistic Kinetic Monte Carlo (KMC) Upscaling Approach

3D Off-Lattice Coarse-Grained Monte Carlo Simulations for Nucleation of Alkaline Aluminosilicate Gels

Dissolution of Portlandite in Pure Water: Part 1 Molecular Dynamics (MD) Approach

Coarse-Grained Monte Carlo Simulations with Octree Cells for Geopolymer Nucleation at Different pH Values

Carbon nanotubes and nanohorns in geopolymers: A study on chemical, physical and mechanical properties

Dissolution of Portlandite in Pure Water: Part 2 Atomistic Kinetic Monte Carlo (KMC) Approach

Dissolution of β-C2S Cement Clinker: Part 1 Molecular Dynamics (MD) Approach for Different Crystal Facets

Silicate Dissolution Mechanism from Metakaolinite Using Density Functional Theory

Interactions between Reduced Graphene Oxide with Monomers of (Calcium) Silicate Hydrates: A First-Principles Study

Finite Element Analysis of Shear Reinforcing of Reinforced Concrete Beams with Carbon Fiber Reinforced Polymer Grid-Strengthened Engineering Cementitious Composite

Correction to: Comprehensive Examination of Dehydroxylation of Kaolinite, Disordered Kaolinite, and Dickite: experimental Studies and Density Functional Theory

Atomistic Insights into Silicate Dissolution of Metakaolinite under Alkaline Conditions: Ab Initio Quantum Mechanical Investigation

Theoretical Elastic Constants of Tobermorite Enhanced with Reduced Graphene Oxide through Hydroxyl vs Epoxy Functionalization: A First-Principles Study

Unexpected Chemical Activity of a Mineral Surface: The Role of Crystal Water in Tobermorite

Molecular dynamics study on the crack propagation in carbon doped polycrystalline boron-nitride nanosheets

The effect of temperature and topological defects on fracture strength of grain boundaries in single-layer polycrystalline boron-nitride nanosheet

Investigation of crack propagation and existing notch on the mechanical response of polycrystalline hexagonal boron-nitride nanosheets

Molecular dynamics study on the mechanical properties of carbon doped single-layer polycrystalline boron-nitride nanosheets

Investigation into the effect of doping of boron and nitrogen atoms in the mechanical properties of single-layer polycrystalline graphene

Atomistic study of the effect of crystallographic orientation on the twinning and detwinning behavior of NiTi shape memory alloys

A quadratic piezoelectric multi-layer shell element for FE analysis of smart laminated composite plates induced by MFC actuators

Modified calculation method of earth pressure and internal force of the abutment-pile in integral abutment jointless bridges

Localized failure analysis of internally pressurized laminated ellipsoidal woven GFRP composite domes: Analytical, numerical, and experimental studies

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