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(Ebook) Discovering Chemistry With Natural Bond Orbitals by Frank Weinhold ISBN 9781118119969, 1118119967

  • SKU: EBN-4646878
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Authors:Frank Weinhold
Pages:336 pages.
Year:2012
Editon:1
Publisher:Wiley
Language:english
File Size:7.06 MB
Format:pdf
ISBNS:9781118119969, 1118119967
Categories: Ebooks

Product desciption

(Ebook) Discovering Chemistry With Natural Bond Orbitals by Frank Weinhold ISBN 9781118119969, 1118119967

This book explores chemical bonds, their intrinsic energies, and the corresponding dissociation energies which are relevant in reactivity problems. It offers the first book on conceptual quantum chemistry, a key area for understanding chemical principles and predicting chemical properties. It presents NBO mathematical algorithms embedded in a well-tested and widely used computer program (currently, NBO 5.9). While encouraging a ''look under the hood'' (Appendix A), this book mainly enables students to gain proficiency in using the NBO program to re-express complex wavefunctions in terms of intuitive chemical concepts and orbital imagery.
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