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Quantum Computational Chemistry
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Quantum Computational Chemistry : Modelling and Calculation for Functional Materials

1st ed. 2018

Book Details

Format Hardback
ISBN-10 9811059322
ISBN-13 9789811059322
Edition 1st ed. 2018
Publisher Springer Verlag, Singapore
Imprint Springer Verlag, Singapore
Country of Manufacture GB
Country of Publication GB
Publication Date Oct 5th, 2017
Print length 290 Pages
KSh 27,000.00
Publisher Out of Stock 0 in stock

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This book is for both theoretical and experimental chemists to begin quantum molecular orbital calculations for functional materials.
This book is for both theoretical and experimental chemists to begin quantum molecular orbital calculations for functional materials. First, the theoretical background including the molecular orbital calculation method and modelling are explained. This is followed by an explanation of how to do modelling and calculation and to interpret calculated molecular orbitals, with many research examples in the field of batteries, catalysts, organic molecules and biomolecules. Finally, future trends in computational chemistry are introduced. 

Get Quantum Computational Chemistry by Taku Onishi at the best price and quality guaranteed only at Werezi Africa's largest book ecommerce store. The book was published by Springer Verlag, Singapore and it has 290 pages.

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