Electron and vibrational spectroscopies using DFT, plane waves and pseudopotentials: CASTEP implementation

Bibliographic Details
Main Authors: Milman, V, Refson, K, Clark, S, Pickard, C, Yates, JR, Gao, S, Hasnip, P, Probert, M, Perlov, A, Segall, MD
Format: Conference item
Published: 2010

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