MODEL

Section can be repeated.

Section for a single NNP model. If this section is repeated, a committee model (C-NNP)is used where the NNP members share the same symmetry functions. [Edit on GitHub]

Keywords

WEIGHTS

Keyword descriptions

WEIGHTS

Type: string
Default: weights

Description: File containing the weights for the artificial neural networks of the NNP. The specified name is extended by .XXX.data

[Edit on GitHub]