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Theoretical Chemistry for Advanced Nanomaterials

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Cover of 'Theoretical Chemistry for Advanced Nanomaterials'

Table of Contents

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    Book Overview
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    Chapter 1 Theoretical Chemistry for Advanced Nanomaterials: Computational and Experimental Approaches
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    Chapter 2 Quantum Chemistry in Perovskite Fluoride and Hydride: Nanoscale Hydride Ion Conduction
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    Chapter 3 Local Dielectric Constant Density Analysis of High-k Dielectric Nanomaterial
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    Chapter 4 Nanoscale First-Principles Electronic Structure Simulations of Materials Relevant to Organic Electronics
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    Chapter 5 Enabling Materials By Dimensionality: From 0D to 3D Carbon-Based Nanostructures
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    Chapter 6 Group 13–15 Needle-Shaped Oligomers and Nanorods: Structures and Electronic Properties
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    Chapter 7 Computational and Experimental Analysis of Carbon Functional Nanomaterials
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    Chapter 8 Electronic Properties of Transition Metal-Benzene Sandwich Clusters
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    Chapter 9 Si Nanopowder for Photoluminescence and Hydrogen Generation Materials
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    Chapter 10 New Na + Superionic Conductor Narpsio Glass-Ceramics
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    Chapter 11 Surface Characterization of Plasma-Electrolytic Oxidized Coatings by X-Ray Photoelectron Spectroscopy
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    Chapter 12 Inter-spin Interactions of Organic Radical Chains in Organic 1D Nanochannels: An ESR Study of the Molecular Orientations and Dynamics of Guest Radicals
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    Chapter 13 If Truncated Wave Functions of Excited State Energy Saddle Points Are Computed as Energy Minima , Where Is the Saddle Point?
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    Chapter 14 Simulating Quantum Dynamics in Classical Nanoscale Environments
Attention for Chapter 13: If Truncated Wave Functions of Excited State Energy Saddle Points Are Computed as Energy Minima , Where Is the Saddle Point?
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Chapter title
If Truncated Wave Functions of Excited State Energy Saddle Points Are Computed as Energy Minima , Where Is the Saddle Point?
Chapter number 13
Book title
Theoretical Chemistry for Advanced Nanomaterials
Published by
Springer, Singapore, January 2020
DOI 10.1007/978-981-15-0006-0_13
Book ISBNs
978-9-81-150005-3, 978-9-81-150006-0
Authors

N. C. Bacalis, Bacalis, N. C.

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Mendeley readers

The data shown below were compiled from readership statistics for 1 Mendeley reader of this research output. Click here to see the associated Mendeley record.

Geographical breakdown

Country Count As %
Unknown 1 100%

Demographic breakdown

Readers by professional status Count As %
Researcher 1 100%
Readers by discipline Count As %
Chemistry 1 100%

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