Hi.
The relax disp manual, on page: 152
in section:
10.6.1 Dispersion script mode – the sample script
The sample script has:
# The dispersion models.
MODELS = ['R2eff', 'No Rex', 'LM63', 'CR72', 'IT99', 'N2 2-site expanded']
The error message is:
relax_disp.select_model(model='N2 2-site expanded')
RelaxError: The model 'N2 2-site expanded' must be one of ['R2eff',
'No Rex', 'LM63', 'TSMFK01', 'LM63 3-site', 'CR72', 'CR72 full',
'IT99', 'M61', 'DPL94', 'M61 skew', 'TP02', 'NS 2-site 3D', 'NS 2-site
3D full', 'NS 2-site star', 'NS 2-site star full', 'NS 2-site
expanded'].
The error is a "2" instead of "S" in
MODELS = ['R2eff', 'No Rex', 'LM63', 'CR72', 'IT99', 'N2 2-site expanded']
Should be:
MODELS = ['R2eff', 'No Rex', 'LM63', 'CR72', 'IT99', 'NS 2-site expanded']
Best
Troels Emtekær Linnet
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