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High-precision calculation of hartree-fock energy of crystals

Gillan, MJ; Alfè, D; De Gironcoli, S; Manby, FR; (2008) High-precision calculation of hartree-fock energy of crystals. Journal of Computational Chemistry , 29 (13) pp. 2098-2106. 10.1002/jcc.21033.

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Type: Article
Title: High-precision calculation of hartree-fock energy of crystals
DOI: 10.1002/jcc.21033
UCL classification: UCL > School of BEAMS
UCL > School of BEAMS > Faculty of Maths and Physical Sciences
URI: http://discovery.ucl.ac.uk/id/eprint/79557
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