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Computational and experimental chemistry : developments and applications

Author: E A Castro; Tanmoy Chakraborty; Michael J Bucknum
Publisher: Toronto ; New Jersey : Apple Academic Press, [2014] ©2014
Edition/Format:   Print book : EnglishView all editions and formats
Database:WorldCat
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Document Type: Book
All Authors / Contributors: E A Castro; Tanmoy Chakraborty; Michael J Bucknum
ISBN: 9781926895291 1926895290
OCLC Number: 851238362
Description: xviii, 335 pages : illustrations ; 24 cm
Contents: Spiro Quantum Chemistry --
Synthesis of Glitter --
Classification of Carbon Allotropes & Graphs --
Many-Body Perturbation Theory to Second Order Applied on Confined Helium-like Atoms --
Distance Dependence of Magnetic Field Effect Inside the Confined Heterogeneous Environment: A Case Study With Acridine and N, N-Dimethyl Anilin Inside AOT Reverse Micelles --
Application of Non-Thermal Plasma For Surface Modification of Polyester Textiles --
Equalization "Principles" in Chemistry --
Ring Opening Metathesis Polymerization Is a Versatile Technique for Making Polymeric Biomaterials --
Correlation of the Experimental and Theoretical Study for the Cyclisation Reaction of Mesoionic HeterocycleImidazo [1,5 a] Pyridines in Terms of the Density Functional Descriptors --
Quantum Breathers and Phonon Bound State in the Ferroelectric System --
Triple Density Quantum Similarity Measures and the Tensorial Representation of Molecular Quantum Object Sets.
Responsibility: edited by Tanmoy Chakraborty, PhD, Michael J. Bucknum, PhD, and Eduardo A. Castro, PhD.

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This book covers a range of new research on computational quantum chemistry, along with a special section devoted to exotic carbon allotropes and spiro quantum theory. The section on spiro quantum theory covers the technical presentation of the ideas surrounding the emergence of a synthetic, analytical, and theoretical spiro quantum chemistry edifice, as well as a chemical topology scheme that successfully describes molecules and patterns, including the hydrocarbons and allotropes of carbon. The second part of the book covers a range of new research on computational quantum chemistry.

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