Lattice constants from semilocal density functionals with zero-point phonon correction.
Autor: | Pan Hao1 adehaopan@gmail.com, Yuan Fang1, Jianwei Sun1, Csonka, Gâbor I.2, Philipsen, Pier H. T.3, Perdew, John P.1 |
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Zdroj: | Physical Review B: Condensed Matter & Materials Physics. Jan-Jun2012, Vol. 85 Issue 1, p1-9. 9p. |
Databáze: | Academic Search Ultimate |
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