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Molecular Simulation on Cement-Based Materials = From Theory to Application /

Record Type:	Language materials, printed : Monograph/item
Title/Author:	Molecular Simulation on Cement-Based Materials/ by Dongshuai Hou.
Reminder of title:	From Theory to Application /
Author:	Hou, Dongshuai.
Description:	XII, 197 p. 121 illus., 105 illus. in color.online resource. :
Contained By:	Springer Nature eBook
Subject:	Structural materials. -
Online resource:	https://doi.org/10.1007/978-981-13-8711-1
ISBN:	9789811387111

Molecular Simulation on Cement-Based Materials = From Theory to Application /
Hou, Dongshuai.

Molecular Simulation on Cement-Based MaterialsFrom Theory to Application /[electronic resource] :by Dongshuai Hou. - 1st ed. 2020. - XII, 197 p. 121 illus., 105 illus. in color.online resource.

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 . .

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.

ISBN: 9789811387111

Standard No.: 10.1007/978-981-13-8711-1doiSubjects--Topical Terms:

1253576
Structural materials.

LC Class. No.: TA401-492

Dewey Class. No.: 620.11

Molecular Simulation on Cement-Based Materials = From Theory to Application /
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505 0 $a 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 . .
520 $a 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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