This dataset comprises the candidates identified by the baseline for all three design tasks of the NMO task. It contains the following information:
Column
Type
Description
task
string
phonon, thermoelectric, or optomechanics
hash
string
Unique molecule hash
benchmark_context__model_name
string
Optimizer name
benchmark_context__model_version
string
Optimizer version
benchmark_context__model_url
string
Repository or paper URL
benchmark_context__hyperparameters
string… See the full description on the dataset page:
https://huggingface.co/datasets/guise868/NMO_Baseline_Relevant_Candidates.
