Citation | 10.1021/acs.jpclett.2c03216 |
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Type | Mass-selected threshold photoelectron spectrum |
Further references | 10.1063/1.4984304 10.1016/j.nima.2009.08.069 |
T / K | 1023 |
Source | Pyrolysis |
Resolution / meV | 5 |
Flux normalization | no |
Comments | Sample (1,3-dinitrobenzene) heated to 80 °C dilluted at 300-500 mbar in argon, expansion through a 100 μm pinhole and subsequent pyrolysis, mass resolution 200, field: 213 V/cm, i2PEPICO (CRF) setup |
Date & facility | Swiss Light Source 2022 |
Date entered | 2020-12-12 |
Citation | 10.1021/acs.jpclett.2c03216 |
---|---|
Type | Franck-Condon simulation |
Further references | Gaussian 16 eZSpectrum |
T / K | 300 |
Level of theory | uBLYP/cc-pVTZ |
Convolution FWHM / meV | 25 |
0-0 transition / eV | 8.65 |
Date & facility | Merlin 6 PSI |
Date entered | 2022-12-09 |