Density functional theory in the solid state

Density functional theory (DFT) has been used in many fields of the physical sciences, but none so successfully as in the solid state. From its origins in condensed matter physics, it has expanded into materials science, high-pressure physics and mineralogy, solid-state chemistry and more, powering...

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Veröffentlicht in:	Philosophical transactions of the Royal Society of London. Series A: Mathematical, physical, and engineering sciences physical, and engineering sciences, 2014-03, Vol.372 (2011), p.20130270-20130270
Hauptverfasser:	Hasnip, Philip J., Refson, Keith, Probert, Matt I. J., Yates, Jonathan R., Clark, Stewart J., Pickard, Chris J.
Format:	Artikel
Sprache:	eng
Schlagworte:	Computational Chemistry Computational Materials Science Condensed Matter Theory Density Functional Theory Electronic Structure Theory Review
Online-Zugang:	Volltext
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