Koch, Wolfram

A chemist's guide to density functional theory / Wolfram Koch, Max C. Holthausen. - 2nd ed. - Weinheim ; New York ; Chichester ; Toronto : Wiley-VCH, 2001. - XIII, 300 str. : ilustr. ; 24 cm.

Bibliografija: str. 265-293. - Kazalo.

9783527303724 3527303723

density functionals -- electronic structure -- quantum chemistry -- electron density -- Hohenberg-Kohn theorems -- thermochemistry -- chemical reactivity --

544.18

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