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Abstract |
We extend the three-layer model for energy loss calculation to include many-body effects in an ab initio framework. The electron energy loss spectrum of the C(100)2x1 surface is calculated and compared with the existing experimental results. We show how many-body effects, namely self-energy, local-fields, and electron-hole interaction, deeply influence the dielectric response and how their inclusion is essential to have good agreement with the experiment. A strong anisotropic behavior of local-field effects on the dielectric response has been observed, while the inclusion of the electron-hole attractive interaction produces a surface-state exciton with binding energy of about 1 eV, confirming a recent theoretical-experimental study of the optical spectra of this surface. |
Year of Publication |
2006
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Journal |
Phys. Rev. B
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Volume |
74
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Date Published |
DEC
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URL |
http://dx.doi.org/10.1103/PhysRevB.74.235431
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DOI |
10.1103/PhysRevB.74.235431
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