EXPLORE THE UNIVERSITY OF OXFORD'S WORLD-CLASS RESEARCH

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1
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Electron and vibrational spectroscopies using DFT, plane waves and pseudopotentials: CASTEP implementation

  • Milman, V, Refson, K, Clark, S, et al.
  • 2010-08-30
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2
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A combined first principles computational and solid-state NMR study of a molecular crystal: flurbiprofen.

  • Yates, JR, Dobbins, SE, Pickard, C, et al.
  • 2005-04-01
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