Article ID Journal Published Year Pages File Type
5417489 Journal of Molecular Structure: THEOCHEM 2009 7 Pages PDF
Abstract

New chemical bonding paradigm in terms of chemical action functional and of its reformulations by means of electronegativity, linear response and density softness kernels is advanced; it makes no use of traditional molecular orbital bonding analysis while providing reliability in identifying the bonding regions through appropriate specialization of the chemical action variational (conservation) principle along the bond length.

Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
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