The MPI-Mainz UV/VIS Spectral Atlas

of Gaseous Molecules of Atmospheric Interest

www.uv-vis-spectral-atlas-mainz.org

Hannelore Keller-Rudek1, Geert K. Moortgat2, Rolf Sander2, Rüdiger Sörensen1

1Satellite Group

2Atmospheric Chemistry Division

Max-Planck Institute for Chemistry
Mainz, Germany

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When referring to the Spectral Atlas, please cite our publication:

Keller-Rudek, H., Moortgat, G. K., Sander, R., and Sörensen, R.: The MPI-Mainz UV/VIS spectral atlas of gaseous molecules of atmospheric interest, Earth Syst. Sci. Data, 5, 365–373, (2013), DOI: 10.5194/essd-5-365-2013

Cross Sections / Sulfur compounds / Inorganic S-compounds / H2SO4 / Farahani(2019)_0K_118.09-341.44nm(calc)

DATAFILE: H2SO4_Farahani(2019)_0K_118.09-341.44nm(calc).txt
NAME: sulfuric acid
FORMULA: H2SO4
AUTHOR(YEAR): Farahani(2019)
T: 0K
λ: 118.09-341.44nm(calc)
BIBLIOGRAPHY: S. Farahani, B.N. Frandsen, H.G. Kjaergaard, and J.R. Lane, "Simulated electronic absorption spectra of sulfur-containing molecules present in Earth’s atmosphere", J. Phys. Chem. A, 123, 6605-6617 (2019); DOI: 10.1021/acs.jpca.9b04668
COMMENTS: Ab initio calculation of the electronic absorption spectrum of sulfuric acid under atmospherically relevant conditions using a nuclear ensemble approach

Test of the method by considering other related sulfur-containing molecules, namely, sulfur dioxide (SO2), sulfur trioxide (SO3), hydrogen sulfide (H2S), carbonyl sulfide (OCS), and carbon disulfide (CS2), where experimental spectra are available

Absorption cross sections for the simulated spectrum have been obtained by personal communication from Benjamin Frandsen (February 2023)

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