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The ONETEP linear-scaling density functional theory program

Lookup NU author(s): Dr Daniel Cole


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Publication metadata

Author(s): Prentice JCA, Aarons J, Womack JC, Allen AEA, Andrinopoulos L, Anton L, Bell RA, Bhandari A, Bramley GA, Charlton RJ, Clements RJ, Cole DJ, Constantinescu G, Corsetti F, Dubois SMM, Duff KKB, Escartín JM, Greco A, Hill Q, Lee LP, Linscott E, O'Regan DD, Phipps MJS, Ratcliff LE, Serrano AR, Tait EW, Teobaldi G, Vitale V, Yeung N, Zuehlsdorff TJ, Dziedzic J, Haynes PD, Hine NDM, Mostofi AA, Payne MC, Skylaris CK

Publication type: Review

Publication status: Published

Journal: Journal of Chemical Physics

Year: 2020

Volume: 152

Pages: 174111

Print publication date: 07/05/2020

Online publication date: 06/05/2020

Acceptance date: 07/04/2020

ISSN (print): 0021-9606

ISSN (electronic): 1089-7690


DOI: 10.1063/5.0004445


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