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Introduction to Computational Chemistry

By (author) Frank Jensen
Format: Paperback / softback
Publisher: John Wiley & Sons Inc, New York, United States
Published: 3rd Feb 2017
Dimensions: w 191mm h 244mm d 28mm
Weight: 975g
ISBN-10: 1118825993
ISBN-13: 9781118825990
Barcode No: 9781118825990
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Synopsis
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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