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Chemical Reactivity Theory

By: India) Chattaraj Pratim Kumar (Indian Institute of Technology Kharagpur Kharagpur (Author)

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Ksh 49,200.00

Format: Hardback or Cased Book

ISBN-13: 9781420065435

Publisher: Taylor & Francis Inc

Publication Date: Feb 23rd, 2009

Dimension: 23.40 x 15.60 x 99.70 cms

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Introduces various aspects of density functional theory (DFT) and their connections to chemical reactivity theory. This work examines bonding, interactions, reactivity, dynamics, toxicity and aromaticity as well as fundamental aspects of DFT. It reviews key global and local reactivity descriptors and their variations under different perturbations.

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