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Simulation and Modeling of Nanomaterials

This Special Issue focuses on computational detailed studies (simulation, modeling, and calculations) of the structures, main properties, and peculiarities of the various nanomaterials (nanocrystals, nanoparticles, nanolayers, nanofibers, nanotubes, etc.) based on various elements, including organic...

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Bibliographic Details
Main Author: Bystrov, Vladimir S.
Format: eBook
Language:English
Published: Basel MDPI - Multidisciplinary Digital Publishing Institute 2022
Subjects:
Structure
Strontium Titanate
Machine Learning
Dipole Moments
Hydroxyapatite Bioceramics
Interfacial Exchange
Off-resonance
Drude Absorption
Slow Light
Chirality
X-ray Absorption Spectroscopy
Semi-empirical Methods
Molecular Modelling
Dft
Defects
Diphenylalanine
Density Functional Theory
Hydroxyapatite
Fitting
Ferroelectrics
Peptide Nanotubes
Hybrid Density Functional
Iron Doping
Structural And Optical Properties
Core-shell Bi-magnetic Nanoparticles
Transition-metal Oxide Clusters
Self-assembly
Atomistic Simulation
Band Gap
Helical Structures
Terahertz
Phenylalanine
Polarization
Tunnel Junction
Graphene
Modeling
Electronic Properties
Absorption
Nanoscale Ferroelectrics
Single Nanowires
Photocurrent
Negative Capacitance
Decomposition Components Of Sf6
Homogeneous Switching
Research & Information: General / Bicssc
Nanomaterials
Kinetics
Crystal Plasticity
Silicon
Substitutions
Water Molecules
Physics / Bicssc
Dipeptides
Iii-nitride
Magnetism
Ir-modified Mos2
Yield Surface
Antireflection Coating
Electronic Density Of States
Nanostructured Polymer Film
Protein Secondary Structure
Plastic Flow
Finite-difference Time-domain Method
Domains
Molecular Modeling
Lgd Theory
Polarization Conversion
Dual Shells
Monte Carlo Simulation
Heterostructures
Dft Calculations
Optoelectronic Devices
Plasmon-induced Transparency
Polycrystalline Aluminum
Computer Simulation
Plasmons
Adsorption And Sensing
Vacancies
Online Access:
Collection: Directory of Open Access Books - Collection details see MPG.ReNa
Description
Summary:This Special Issue focuses on computational detailed studies (simulation, modeling, and calculations) of the structures, main properties, and peculiarities of the various nanomaterials (nanocrystals, nanoparticles, nanolayers, nanofibers, nanotubes, etc.) based on various elements, including organic and biological components, such as amino acids and peptides. For many practical applications in nanoelectronics., such materials as ferroelectrics and ferromagnetics, having switching parameters (polarization, magnetization), are highly requested, and simulation of dynamics and kinetics of their switching are a very important task. An important task for these studies is computer modeling and computational research of the properties on the various composites of the other nanostructures with polymeric ferroelectrics and with different graphene-like 2-dimensional structures. A wide range of contemporary computational methods and software are used in all these studies.
Item Description:Creative Commons (cc), https://creativecommons.org/licenses/by/4.0/
Physical Description:1 electronic resource (270 p.)
ISBN:books978-3-0365-4740-4
9783036547404
9783036547398

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