Description: Theoretical Chemistry for Advanced Nanomaterials Please note: this item is printed on demand and will take extra time before it can be dispatched to you (up to 20 working days). Functional Analysis by Computation and Experiment Author(s): Taku Onishi Format: Paperback Publisher: Springer Verlag, Singapore, Singapore Imprint: Springer Verlag, Singapore ISBN-13: 9789811500084, 978-9811500084 Synopsis This book collects recent topics of theoretical chemistry for advanced nanomaterials from the points of view of both computational and experimental chemistry. It is written for computational and experimental chemists, including undergraduate students, who are working with advanced nanomaterials, where collaboration and interplay between computation and experiment are essential. After the general introduction of nanomaterials, several computational approaches are explained in Part II. Each chapter presents not only calculation methods but also concrete calculation results for advanced nanomaterials. Hydride ion conducting nanomaterials, high-k dielectric nanomaterials, and organic electronics are focused on. In Part III, the interplay between computational and experimental approaches is explained. The chapters show calculation results, combined with corresponding experimental data. Dimensionality of nanomaterials, electronic structure of oligomers and nanorods, carbon nanomaterials, and the electronic structure of a nanosized sandwich cluster is looked at carefully. In Part IV, functionality analysis is explained from the point of view of the experimental approach. The emphasis is on the mechanism of photoluminescence and hydrogen generation using silicon nanopowder, the superionic conducting mechanism of glass ceramics, nanoclusters formation on the surface of metal oxides, and the magnetic property of an organic one-dimensional nanochannel. Finally, forthcoming theoretical methods for excited states and quantum dynamics are introduced in Part V.
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Location: Aldershot
End Time: 2025-01-16T09:18:24.000Z
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Book Title: Theoretical Chemistry for Advanced Nanomaterials
Number of Pages: 544 Pages
Publication Name: Theoretical Chemistry for Advanced Nanomaterials: Functional Analysis by Computation and Experiment
Language: English
Publisher: Springer Verlag, Singapore
Item Height: 235 mm
Subject: Chemistry
Publication Year: 2021
Type: Textbook
Item Weight: 1002 g
Subject Area: Nanotechnology
Author: Taku Onishi
Item Width: 155 mm
Format: Paperback
