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Physica Status Solidi (B) Basic Research

Volumn 248, Issue 6, 2011, Pages 1309-1318

Accurate Kohn-Sham DFT with the speed of tight binding: Current techniques and future directions in materials modelling

(2) Briddon, P R a Rayson, M J b,c

a NEWCASTLE UNIVERSITY (United Kingdom)

b MAX PLANCK INSTITUT FÜR EISENFORSCHUNG GMBH (Germany)

c LULEÅ UNIVERSITY OF TECHNOLOGY (Sweden)

Author keywords

Density functional theory; Electronic structure; Filter diagonalisation; Large scale calculations

Indexed keywords

EID: 78651336583 PISSN: 03701972 EISSN: 15213951 Source Type: Journal
DOI: 10.1002/pssb.201046147 Document Type: Article

Times cited : (62)

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