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Raman spectra of long chain hydrocarbons: anharmonic calculations, experiment and implications for imaging of biomembranes
First-principles anharmonic vibrational calculations are carried out for the Raman spectrum of the C–H stretching bands in dodecane, and for the C–D bands in the deuterated molecule. The calculations use the Vibrational Self-Consistent Field (VSCF) algorithm. The results are compared with liquid-sta...
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| Main Authors: | , , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
2011
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3501252/ https://ncbi.nlm.nih.gov/pubmed/21670823 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c1cp20618d |
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