Closed ThijsSmolders closed 1 year ago
For example, the following output is generated, but the order of the elements is random and can not be initialised in a consistent manner.
Generating one-body information from training-set. Added elements: O C H Li Generating two-body potentials from one-body information.
For example, the following output is generated, but the order of the elements is random and can not be initialised in a consistent manner.
Generating one-body information from training-set. Added elements: O C H Li Generating two-body potentials from one-body information.