PSI VUV About Database

ms-TPES

Citation 10.1021/acs.jpca.5c02601
Type Mass-selected threshold photoelectron spectrum
Further references 10.1063/1.4984304
10.1016/j.nima.2009.08.069
T / K 660
Source Pyrolysis
Resolution / meV 5
Flux normalization No
Comments Trimethylgallium was diluted in argon and expanded through a SiC reactor. Mass resolution 200, field: 213 V/cm, i2PEPICO (CRF) setup.
Date & facility 2023, SLS,, PSI
Date entered 2025-06-18
EK

FC simulation X+ 2A1

Citation 10.1021/acs.jpca.5c02601
Type Franck-Condon simulation
Further references 10.1002/wcms.1546
10.1002/wcms.81
T / K 1000
Level of theory CCSD(T)/cc-pVTZ
Convolution FWHM / meV 25
0-0 transition / eV 7.90
Comments Simulation was made with EzSpectrum. Calculations were performed with Orca 5.0.3
Date & facility 2025 Universität Würzburg
Date entered 2025-06-18
EK