In general it depends on the orbital momentum. For 3d transitions metals there is no unique answer as for a given number of 3d electrons there are several possible spin states, depending on the strength of magnetic interactions and crystal field splitting.
I am new to XPS Data analysis, and I have a .sle file that I got out of XPS Machine Software, and I am using CasaXPS to analyse the data. This software takes only .vms files. I want to convert the .sle to a .vms file for analysis. How or where can I do this? Any help on this will be deeply appreciated.