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Bond Orders and Energy Components - Extracting Chemical Information from Molecular Wave Functions (Paperback) Loot Price: R2,269
Discovery Miles 22 690
Bond Orders and Energy Components - Extracting Chemical Information from Molecular Wave Functions (Paperback): Istvan Mayer

Bond Orders and Energy Components - Extracting Chemical Information from Molecular Wave Functions (Paperback)

Istvan Mayer

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Loot Price R2,269 Discovery Miles 22 690 | Repayment Terms: R213 pm x 12*

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While modern computational methods can provide us with the wave function of a molecule in numerical form, most computer programs lack the sophisticated tools needed to extract chemical concepts from these wave functions. Saving researchers vast time and potential confusion, this volume collects and organizes those validated tools currently scattered throughout the literature and details their application. It provides immediate access for those needing to calculate such critical factors as bond order and valence indices, and atomic and diatomic contributions to molecular energy. Supporting material is available for download from the authors' continually updated website.

General

Imprint: Crc Press
Country of origin: United Kingdom
Release date: December 2021
First published: 2017
Authors: Istvan Mayer
Dimensions: 234 x 156mm (L x W)
Format: Paperback
Pages: 240
ISBN-13: 978-0-367-86484-2
Categories: Books > Science & Mathematics > Physics > Atomic & molecular physics
Books > Science & Mathematics > Physics > Applied physics & special topics > Chemical physics
Books > Science & Mathematics > Chemistry > Physical chemistry > General
Books > Science & Mathematics > Biology, life sciences > Life sciences: general issues > General
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LSN: 0-367-86484-3
Barcode: 9780367864842

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