Standard

C 1s →π* excitation in variable size benzene clusters. / Bradeanu, I. L.; Flesch, R.; Kosugi, N.; Pavlychev, A. A.; Rühl, E.

In: Physical Chemistry Chemical Physics, Vol. 8, No. 16, 13.04.2006, p. 1906-1913.

Research output: Contribution to journal › Article › peer-review

Harvard

Bradeanu, IL, Flesch, R, Kosugi, N, Pavlychev, AA & Rühl, E 2006, 'C 1s →π* excitation in variable size benzene clusters', Physical Chemistry Chemical Physics, vol. 8, no. 16, pp. 1906-1913. https://doi.org/10.1039/b517199g

APA

Bradeanu, I. L., Flesch, R., Kosugi, N., Pavlychev, A. A., & Rühl, E. (2006). C 1s →π* excitation in variable size benzene clusters. Physical Chemistry Chemical Physics, 8(16), 1906-1913. https://doi.org/10.1039/b517199g

Vancouver

Bradeanu IL, Flesch R, Kosugi N, Pavlychev AA, Rühl E. C 1s →π* excitation in variable size benzene clusters. Physical Chemistry Chemical Physics. 2006 Apr 13;8(16):1906-1913. https://doi.org/10.1039/b517199g

Author

Bradeanu, I. L. ; Flesch, R. ; Kosugi, N. ; Pavlychev, A. A. ; Rühl, E. / C 1s →π* excitation in variable size benzene clusters. In: Physical Chemistry Chemical Physics. 2006 ; Vol. 8, No. 16. pp. 1906-1913.

BibTeX

@article{0901266a96dd4b0e932b981b7d23afdf,
title = "C 1s →π* excitation in variable size benzene clusters",
abstract = "The C 1s →π* transition in molecular benzene and benzene clusters is investigated by photoion yields at high energy resolution. The vibrationally resolved band shows the same shape in clusters as in the bare molecule, but it is redshifted by 50 meV in small clusters, i.e. near the threshold of cluster formation. This redshift increases to 70 meV with increasing cluster size. The results are assigned in comparison with ab initio calculations on model structures of dimers, trimers, and tetramers. These indicate that different carbon sites in the molecular moieties give rise to distinct spectral shifts, where carbon sites that are pointing to the π-system of another molecule show a larger redshift than the other ones. Such structural properties are found in solid benzene, so that the gas-to-solid shift of C 1s →π* excited benzene is derived to be a redshift which is of the order of 100-180 meV.",
author = "Bradeanu, {I. L.} and R. Flesch and N. Kosugi and Pavlychev, {A. A.} and E. R{\"u}hl",
year = "2006",
month = apr,
day = "13",
doi = "10.1039/b517199g",
language = "English",
volume = "8",
pages = "1906--1913",
journal = "Transactions of the Faraday Society",
issn = "1463-9076",
publisher = "Royal Society of Chemistry",
number = "16",

}

RIS

TY - JOUR

T1 - C 1s →π* excitation in variable size benzene clusters

AU - Bradeanu, I. L.

AU - Flesch, R.

AU - Kosugi, N.

AU - Pavlychev, A. A.

AU - Rühl, E.

PY - 2006/4/13

Y1 - 2006/4/13

N2 - The C 1s →π* transition in molecular benzene and benzene clusters is investigated by photoion yields at high energy resolution. The vibrationally resolved band shows the same shape in clusters as in the bare molecule, but it is redshifted by 50 meV in small clusters, i.e. near the threshold of cluster formation. This redshift increases to 70 meV with increasing cluster size. The results are assigned in comparison with ab initio calculations on model structures of dimers, trimers, and tetramers. These indicate that different carbon sites in the molecular moieties give rise to distinct spectral shifts, where carbon sites that are pointing to the π-system of another molecule show a larger redshift than the other ones. Such structural properties are found in solid benzene, so that the gas-to-solid shift of C 1s →π* excited benzene is derived to be a redshift which is of the order of 100-180 meV.

AB - The C 1s →π* transition in molecular benzene and benzene clusters is investigated by photoion yields at high energy resolution. The vibrationally resolved band shows the same shape in clusters as in the bare molecule, but it is redshifted by 50 meV in small clusters, i.e. near the threshold of cluster formation. This redshift increases to 70 meV with increasing cluster size. The results are assigned in comparison with ab initio calculations on model structures of dimers, trimers, and tetramers. These indicate that different carbon sites in the molecular moieties give rise to distinct spectral shifts, where carbon sites that are pointing to the π-system of another molecule show a larger redshift than the other ones. Such structural properties are found in solid benzene, so that the gas-to-solid shift of C 1s →π* excited benzene is derived to be a redshift which is of the order of 100-180 meV.

UR - http://www.scopus.com/inward/record.url?scp=33744486329&partnerID=8YFLogxK

U2 - 10.1039/b517199g

DO - 10.1039/b517199g

M3 - Article

C2 - 16633677

AN - SCOPUS:33744486329

VL - 8

SP - 1906

EP - 1913

JO - Transactions of the Faraday Society

JF - Transactions of the Faraday Society

SN - 1463-9076

IS - 16

ER -

ID: 43207214