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Ab Initio Calculations

By: Maria Emilova Velinova (Author)

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Ksh 42,950.00

Format: Hardback or Cased Book

ISBN-13: 9781773610870

Publisher: Arcler Education Inc

Publication Date: Nov 1st, 2017

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Provides an overview of the most used ab initio quantum methods and their applications in different fields. Ab initio calculations offer results and details that are not obtainable from experimental data and a degree of assurance which is not accessible with the empirical methods. The methods Hartree-Fock, Moller-Plesset Perturbation theory and Coupled Cluster theory are discussed.

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