Pressure effects in DebyeWaller factors and in EXAFS

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Pressure effects in DebyeWaller factors and in EXAFS

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dc.contributor.author Van Hung, N.
dc.contributor.author Hung, V.V.
dc.contributor.author Hieu, H.K.
dc.contributor.author Frahm, R.R.
dc.date.accessioned 2011-05-05T02:38:44Z
dc.date.available 2011-05-05T02:38:44Z
dc.date.issued 2011
dc.identifier.citation Volume: 406 Issue: 3 Page : 456-460 vi
dc.identifier.issn 9214526
dc.identifier.uri http://tainguyenso.vnu.edu.vn/jspui/handle/123456789/6563
dc.description.abstract Anharmonic correlated Einstein model (ACEM) and statistical moment method (SMM) have been developed to derive analytical expressions for pressure dependence of the lattice bond length, effective spring constant, correlated Einstein frequency and temperature, DebyeWaller factors (DWF) or second cumulant, first and third cumulants in Extended X-ray Absorption Fine Structure (EXAFS) at a given temperature. Numerical results for pressure-dependent DWF of Kr and Cu agree well with experiment and other theoretical values. Simulated EXAFS of Cu and its Fourier transform magnitude using our calculated pressure-induced change in the 1st shell are found to be in a reasonable agreement with those using X-ray diffraction (XRD) experimental results. ?? 2010 Elsevier B.V. All rights reserved. vi
dc.language.iso en vi
dc.publisher Physica B: Condensed Matter vi
dc.subject DebyeWaller factors and cumulants vi
dc.subject EXAFS vi
dc.subject Pressure dependence effects vi
dc.title Pressure effects in DebyeWaller factors and in EXAFS vi
dc.type Article vi

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