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1997 (3)

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Charge sensitivity approach to electronic structure and chemical reactivity
Authors: ---
ISBN: 9812831002 9789812831002 9810222459 9789810222451 Year: 1997 Publisher: Singapore : World Scientific Pub. Co.,

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Abstract

Charge Sensitivity Analysis (CSA) represents a linear response treatment of molecular systems, based upon the chemical potential and hardness/softness concepts established within density functional theory (DFT). Recently, it has been shown to provide an attractive framework leading to novel approaches to chemical reactivity of open systems. The monograph presents the conceptual and methodological basis of the CSA covering its DFT roots, alternative resolutions and representations, sensitivities of closed and open atomic and molecular systems, charge stability criteria and relaxational effects

Advanced problems in organic reaction mechanisms
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ISBN: 0080432565 0080432557 1281053635 9786611053635 0080498779 9780080498775 9780080432564 9780080432557 Year: 1997 Volume: 16 Publisher: Oxford, U.K. ; New York : Pergamon,

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Abstract

The Elsevier Tetrahedron Organic Chemistry Series is a topical series of monographs by world-renowned scientists in several fields of organic chemistry. The Tetrahedron Organic Chemistry Series has been very successful in providing some of the very best scholarly works in these topical areas that have proven to be of lasting quality as indispensable reference sources. These books have provided the practicing researcher, student and scholar with an invaluable source of comprehensive reviews in organic chemistry, predominantly in the areas of synthesis and structure determination, including:

The molecular solid state.
Authors: --- --- ---
ISBN: 047195232X 9780471952329 0471961876 0471999075 Year: 1997 Publisher: Chichester : Wiley,

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