University of Oulu

Electronic structure according to the orbital approximation and the Hartree-Fock theory with electron correlation methods

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Author: Abuzaid, Nuha1
Organizations: 1University of Oulu, Faculty of Science, Physics
Format: ebook
Version: published version
Access: open
Online Access: PDF Full Text (PDF, 0.6 MB)
Pages: 40
Persistent link:
Language: English
Published: Oulu : N. Abuzaid, 2016
Publish Date: 2016-11-14
Thesis type: Bachelor's thesis
Hartree-Fock theory, a computational method to solve electronic structure of molecules, is reviewed in this thesis. The emphasis is on spotlighting the physical reasoning behind the assumptions of the Hartree-Fock theory. Also, three post-Hartree-Fock electron correlation methods are introduced, configuration interaction, coupled cluster, and Møller-Plesset theory.
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Copyright information: © Nuha Abuzaid, 2016. This publication is copyrighted. You may download, display and print it for your own personal use. Commercial use is prohibited.