Open rs028 opened 2 years ago
There 2 main problems with the calculation of JFAC:
The first is probably solvable with simple modifications to the code (e.g. appropriate threshold for COSX, see #276).
The second requires a different approach and/or a new algorithm to calculate JFAC.
With regard to the second point, this paper https://pubs.rsc.org/en/content/articlehtml/2022/ea/d2ea00072e may be helpful.
There 2 main problems with the calculation of JFAC:
The first is probably solvable with simple modifications to the code (e.g. appropriate threshold for COSX, see #276).
The second requires a different approach and/or a new algorithm to calculate JFAC.