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Goals story basics

In this section, we begin a review of some key ideas from quantum mechanics that underlie DFT (and other forms of computational chemistry). Our goal here is not to present a complete derivation of the techniques used in DFT. Instead, our goal is to give a clear, brief, introductory presentation of the most basic equations important for DFT. For the full story, there are a number of excellent texts devoted to quantum mechanics listed in the Further Reading section at the end of the chapter. [Pg.8]


See other pages where Goals story basics is mentioned: [Pg.814]    [Pg.185]    [Pg.5]    [Pg.66]    [Pg.14]    [Pg.662]    [Pg.36]    [Pg.313]    [Pg.3]   
See also in sourсe #XX -- [ Pg.24 ]




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