DSCDM Machine Learning Predictor

This predictor is case sensitive. This predictor does not support any molecules containing lanthanides or actinides. Values entered need not have units, but they should correspond to those of typical spectroscopic units (see the database) Our R_e predictor uses the groups and periods of the constituent atoms of the diatomic molecule as features. Our ω_e predictor uses the reduced mass, groups and periods, and R_e of the diatomic molecule as its features. Our D₀ predictor uses the groups and periods, R_e, and ω_e as its features. Finally, our ω_eχ_e predictor uses the groups and periods, R_e, and ω_e of the diatomic molecule as its features with the reduced mass added as a feature for the neural network (NN) prediction.