PSI VUV About Database

ms-TPES

Citation 10.1021/acs.jpca.5c02601
Type Mass-selected threshold photoelectron spectrum
Further references 10.1063/1.3082016
10.1016/j.nima.2009.08.069
T / K 650
Source Pyrolysis
Resolution / meV 5
Flux normalization No
Comments Trimethylalluminium was diluted in argon and expanded through a SiC reactor.Mass resolution 200, field: 213 V/cm, i2PEPICO (CRF) setup
Date & facility SLS
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.81
10.1002/wcms.1546
T / K 800
Level of theory CCSD(T)/cc-pVTZ
Convolution FWHM / meV 40
0-0 transition / eV 7.89
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