Lataa...

Assessment of electron propagator methods for the simulation of vibrationally-resolved valence and core photoionization spectra

The analysis of photoelectron spectra is usually facilitated by quantum mechanical simulations. Due to the recent improvement of experimental techniques, the resolution of experimental spectra is rapidly increasing, and the inclusion of vibrational effects is usually mandatory to obtain a reliable r...

Täydet tiedot

Tallennettuna:
Bibliografiset tiedot
Julkaisussa:J Chem Theory Comput
Päätekijät: Baiardi, A., Paoloni, L., Barone, V., Zakrzewski, V.G., Ortiz, J.V.
Aineistotyyppi: Artigo
Kieli:Inglês
Julkaistu: 2017
Aiheet:
Linkit:https://ncbi.nlm.nih.gov/pmc/articles/PMC5732571/
https://ncbi.nlm.nih.gov/pubmed/28521087
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jctc.6b00958
Tagit: Lisää tagi
Ei tageja, Lisää ensimmäinen tagi!