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Molecular Simulation on Cement-Based Materials: From Theory to Application de Dongshuai Hou

Molecular Simulation on Cement-Based Materials: From Theory to Application

Autor Dongshuai Hou
en Limba Engleză Hardback – 8 oct 2019
This book presents a number of studies on the molecular dynamics of cement-based materials. It introduces a practical molecular model of cement-hydrate, delineates the relationship between molecular structure and nanoscale properties, reveals the transport mechanism of cement-hydrate, and provides useful methods for material design. Based on the molecular model presented here, the book subsequently sheds light on nanotechnology applications in the design of construction and building materials. As such, it offers a valuable asset for researchers, scientists, and engineers in the field of construction and building materials. 

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Specificații

ISBN-13: 9789811387104
ISBN-10: 9811387109
Pagini: 265
Ilustrații: XII, 197 p. 121 illus., 105 illus. in color.
Dimensiuni: 155 x 235 mm
Greutate: 0.48 kg
Ediția:1st ed. 2020
Editura: Springer Nature Singapore
Colecția Springer
Locul publicării:Singapore, Singapore

Cuprins

Background and objectives.- Introduction to modeling of cement hydrate at nano-scale.- Introduction to simulation techniques on the cement-based materials.- Modeling the calcium silicate Hydrate by molecular simulation.- Molecular simulation of water and ions migration in the nanometer channel of calcium silicate phase.- Models for the cross-linked calcium aluminate silicate hydrate (C-A-S-H) gel.- Molecular dynamics study on cement-graphene nanocomposite.- The future and development trends of computational chemistry applied in concrete science .          

Notă biografică

Dongshuai Hou is a Professor at the Department of Civil Engineering, Qingdao University of Technology. He received his Doctor degree from Hong Kong University of Science and Technology in 2014. His research interests include the molecular structure and behavior of cement-hydrate; ab initio, molecular dynamics, and other computational chemistry methods; and multi-scale studies on concrete materials.  To date, he has published more than 80 academic papers in the field of concrete material and computational chemistry.

Textul de pe ultima copertă

This book presents a number of studies on the molecular dynamics of cement-based materials. It introduces a practical molecular model of cement-hydrate, delineates the relationship between molecular structure and nanoscale properties, reveals the transport mechanism of cement-hydrate, and provides useful methods for material design. Based on the molecular model presented here, the book subsequently sheds light on nanotechnology applications in the design of construction and building materials. As such, it offers a valuable asset for researchers, scientists, and engineers in the field of construction and building materials.

Caracteristici

Presents numerous case studies to facilitate readers’ understanding of the molecular dynamics (MD) theory Introduces a molecular model of cement-hydrate Combines theoretical studies with experimental results Provides valuable guidance on practical material design