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Title
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Computation and parametrization of the temperature dependence of Debye-Waller factors for group IV, III-V and II-VI semiconductors
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Author
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Abstract
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| We calculated the temperature dependence of the Debye-Waller factors for a variety of group IV, III-V and II-VI semiconductors from 0.1 to 1000 K. The approach used to fit the temperature dependence is described and resulting fit parameters are tabulated for each material. The Debye-Waller factors are deduced from generalized phonon densities of states which were derived from first principles using the WIEN2k and the ABINIT codes. |
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Language
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English
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Source (journal)
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Acta crystallographica: section A: foundations of crystallography. - Copenhagen
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Publication
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Copenhagen
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2009
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ISSN
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0108-7673
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DOI
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10.1107/S0108767308031437
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Volume/pages
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65
:1
(2009)
, p. 5-17
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ISI
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000261799500002
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Full text (Publisher's DOI)
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