Introduction to Computational Chemistry

Nonfiction, Science & Nature, Science, Chemistry, Physical & Theoretical
Cover of the book Introduction to Computational Chemistry by Frank Jensen, Wiley
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Author: Frank Jensen ISBN: 9781118825952
Publisher: Wiley Publication: December 14, 2016
Imprint: Wiley Language: English
Author: Frank Jensen
ISBN: 9781118825952
Publisher: Wiley
Publication: December 14, 2016
Imprint: Wiley
Language: English

Introduction to Computational Chemistry 3rd Edition provides a comprehensive account of the fundamental principles underlying different computational methods. Fully revised and updated throughout to reflect important method developments and improvements since publication of the previous edition, this timely update includes the following significant revisions and new topics:

  • Polarizable force fields
  • Tight-binding DFT
  • More extensive DFT functionals, excited states and time dependent molecular properties
  • Accelerated Molecular Dynamics methods
  • Tensor decomposition methods
  • Cluster analysis
  • Reduced scaling and reduced prefactor methods

Additional information is available at: www.wiley.com/go/jensen/computationalchemistry3

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Introduction to Computational Chemistry 3rd Edition provides a comprehensive account of the fundamental principles underlying different computational methods. Fully revised and updated throughout to reflect important method developments and improvements since publication of the previous edition, this timely update includes the following significant revisions and new topics:

Additional information is available at: www.wiley.com/go/jensen/computationalchemistry3

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