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Molecular simulation on cement-based...

Hou, Dongshuai.

Molecular simulation on cement-based materialsfrom theory to application /

紀錄類型:	書目-電子資源 : Monograph/item
正題名/作者:	Molecular simulation on cement-based materialsby Dongshuai Hou.
其他題名:	from theory to application /
作者:	Hou, Dongshuai.
出版者:	Singapore :Springer Singapore :2020.
面頁冊數:	xii, 197 p. :ill. (some col.), digital ;24 cm.
Contained By:	Springer eBooks
標題:	CementSimulation methods.
電子資源:	https://doi.org/10.1007/978-981-13-8711-1
ISBN:	9789811387111$q(electronic bk.)

Molecular simulation on cement-based materialsfrom theory to application /
Hou, Dongshuai.

Molecular simulation on cement-based materialsfrom theory to application /[electronic resource] :by Dongshuai Hou. - Singapore :Springer Singapore :2020. - xii, 197 p. :ill. (some col.), digital ;24 cm.

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$q(electronic bk.)

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

866172
Cement
--Simulation methods.

LC Class. No.: TA434

Dewey Class. No.: 620.135

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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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