Figure 6
The comparison of the experimental (dashed line) with the ab initio full multiple-scattering calculation (solid line) XANES spectra of BrNph dissolved in SCF Xe. A Debye–Waller factor of 0.2 Å was used in the calculation. The configuration of the Xe atoms around the BrNph molecule is also shown. The hatched circle represents the Br atom located at the centre of an f.c.c. lattice of Xe atoms. |