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Vibrational properties of 2H-PbI2 semiconductors studied via Density Functional Theory calculations.
- Source :
-
Thin Solid Films . Aug2013, Vol. 541, p9-11. 3p. - Publication Year :
- 2013
-
Abstract
- Abstract: Density Functional Theory is used to study the vibrational properties of 2H-PbI2 semiconductor. The Born charge tensors are determined. Calculated phonon frequencies at the Brillouin zone center are compared to Raman scattering and IR absorption measurements. The computed Raman spectra show a good agreement with available experimental data. The simulated phonon dispersion curves are compared with triple-axis neutron scattering measurements. [Copyright &y& Elsevier]
Details
- Language :
- English
- ISSN :
- 00406090
- Volume :
- 541
- Database :
- Academic Search Index
- Journal :
- Thin Solid Films
- Publication Type :
- Academic Journal
- Accession number :
- 89435324
- Full Text :
- https://doi.org/10.1016/j.tsf.2012.10.129