This book presents a wealth of results obtained by first-principles calculations, molecular dynamics simulations, and tight-binding modeling on two-dimensional covalent bonding and the resulting formation of 2D materials.

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This book presents a wealth of results obtained by first-principles calculations, molecular dynamics simulations, and tight-binding modeling on two-dimensional covalent bonding and the resulting formation of 2D materials. It focuses on the bonding–structure relationships derived from the periodicity of the electron configuration and atomic size, paying particular attention to the overall stability of various elemental and composite networks. In addition to accurate first-principles calculations, the book uses a linear combination of atomic orbitals and the hybridization concept to gain deep insight into the rules governing the world of 2D chemistry.

 Of special interest are the novel properties of 2D materials based on quantum confinement effects in two dimensions and the large surface-to-volume ratio. The book gives an introduction to the fundamental principles of 2D structure formation for newcomers in this field, simultaneously providing a comprehensive source of data on bonding strength, geometrical structure, and nanomechanics characterizing the manifold of chemical networks in two-dimensional space. This book is a valuable reference for material scientists, chemists, and any researcher in the field of 2D materials and low-dimensional nanoscience.

 

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Covers the basic theoretical knowledge needed to understand elemental bonding and structure formation in two-dimensional space Focuses on bonding–structure relationships in of monolayers with attention given to thermodynamical, dynamical, mechanical, and thermal stability Presents a wealth of results obtained by first-principles calculations, molecular dynamics simulations, and tight-binding modeling
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Produktdetaljer

ISBN
9783031741609
Publisert
2025-04-11
Utgiver
Springer International Publishing AG
Høyde
235 mm
Bredde
155 mm
Aldersnivå
Research, P, UP, 06, 05
Språk
Product language
Engelsk
Format
Product format
Innbundet
Antall sider
23

Forfatter