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Convergence and pitfalls of density functional perturbation theory phonons calculations from a high-throughput perspective

Bibliographic reference Petretto, Guido ; Gonze, Xavier ; Hautier, Geoffroy ; Rignanese, Gian-Marco. Convergence and pitfalls of density functional perturbation theory phonons calculations from a high-throughput perspective. In: Computational Materials Science, Vol. 144, p. 331-337 (2018)
Permanent URL http://hdl.handle.net/2078.1/191940