Citation | 10.1021/jp5085982 |
---|---|
Type | Mass-selected threshold photoelectron spectrum |
Further references | 10.1063/1.3082016 10.1016/j.nima.2009.08.069 |
T / K | 300 |
Source | effusive inlet |
Resolution / meV | 5 |
Flux normalization | no |
Comments | mass resolution: 200, 120 V/cm extraction, effusive inlet system, 600 l/mm grating |
Date & facility | 2014, SLS |
Date entered | 2025-04-04 |
Citation | 10.1021/jp5085982 |
---|---|
Type | Mass-selected threshold photoelectron spectrum |
Further references | 10.1063/1.3082016 10.1016/j.nima.2009.08.069 |
T / K | 298 |
Source | effusive inlet |
Resolution / meV | 2 |
Flux normalization | no |
Comments | mass resolution: 200, 120 V/cm extraction, effusive inlet system, 600 l/mm grating |
Date & facility | 2014, SLS |
Date entered | 2025-04-04 |
Citation | 10.1021/jp5085982 |
---|---|
Type | Franck-Condon simulation |
Further references | Gaussian 09 eZSpectrum |
T / K | 0 |
Level of theory | B3LYP/6-311+G(d,p) |
Convolution FWHM / meV | 19 |
0-0 transition / eV | 8.81 |
Comments | The baseline shift in the TPES due to autoionization (above 8.84 eV) was taken into account using a sigmoid function. |
Date & facility | 2014, Merlin PSI |
Date entered | 2025-04-04 |
Citation | 10.1021/jp5085982 |
---|---|
Type | Franck-Condon simulation |
Further references | Gaussian 09 eZSpectrum |
T / K | 0 |
Level of theory | TD-B3LYP/6-311+G(d,p) |
Convolution FWHM / meV | 19 |
0-0 transition / eV | 10.33 |
Date & facility | 2014, Merlin PSI |
Date entered | 2025-04-04 |
Citation | 10.1021/jp5085982 |
---|---|
Type | Franck-Condon simulation |
Further references | Gaussian 09 eZSpectrum |
T / K | 0 |
Level of theory | TD-B3LYP/6-311+G(d,p) |
Convolution FWHM / meV | 19 |
0-0 transition / eV | 11.02 |
Date & facility | 2014, Merlin PSI |
Date entered | 2025-04-04 |