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Chemical Reactivity Theory
A Density Functional View
Introduction to Density Functional Theory
In the 1970s, Density Functional Theory (DFT) was borrowed from physics and adapted to chemistry by a handful of visionaries. Now chemical DFT is a diverse and rapidly growing field, its progress fueled by numerous developing practical descriptors that make DFT as useful as it is vast.
With 34 chapters written by 65 eminent scientists from 13 diffe
