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Notes on simulating two-dimensional Raman and terahertz-Raman signals with a full molecular dynamics simulation approach

Recent developments in two-dimensional (2D) THz-Raman and 2D Raman spectroscopies have created the possibility for quantitatively investigating the role of many dynamic and structural aspects of the molecular system. We explain the significant points for properly simulating 2D vibrational spectrosco...

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Detalles Bibliográficos
Autores principales: Ito, Hironobu, Jo, Ju-Yeon, Tanimura, Yoshitaka
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Crystallographic Association 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4711663/
https://www.ncbi.nlm.nih.gov/pubmed/26798823
http://dx.doi.org/10.1063/1.4932597