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Psi-k highlight November 2021 (No replies)

Leon Petit
3 years ago
Leon Petit 3 years ago

Dear All,

Please note that the November 2021 Psi-k Scientific Highlight article entitled

DFTB+, a software package for efficient approximate density functional
theory based atomistic simulations

by B. Hourahine et al.

is available for viewing at or downloading from the Psi-k Webpage

psi-k.net/highlights

or directly at

psi-k.net/download/highlights/Highlight_153.pdf

Best Regards

Psi-k coordinator ([email protected])




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Ab initio (from electronic structure) calculation of complex processes in materials