Plato: A localised orbital based density functional theory code

The Plato package allows both orthogonal and non-orthogonal tight-binding as well as density functional theory (DFT) calculations to be performed within a single framework. The package also provides extensive tools for analysing the results of simulations as well as a number of tools for creating in...

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Veröffentlicht in:	Computer physics communications 2009-12, Vol.180 (12), p.2616-2621
Hauptverfasser:	Kenny, S.D., Horsfield, A.P.
Format:	Artikel
Sprache:	eng
Schlagworte:	Density functional theory Localised orbitals
Online-Zugang:	Volltext
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