Published March 7, 2024 | Version v1

Dataset for NFA based organic solarcells till mid 2020

  • 1. ROR icon University of Chinese Academy of Sciences
  • 2. ROR icon National Center for Nanoscience and Technology

Description

Dataset for NFA based organic solarcells till mid 2020.

Source of the data please find the reference tab in dataset.csv.

contains:

dataset.csv - main dataset file.

SMILES_donor - SMILES for polymer donor in the dataset.

SMILES_NFAs - SMILES for acceptors in the dataset.

NFA_subdict - dictionary to translate full NFA molecules into sub units.

NFA_sub_core - SMILES for core sub units.

NFA_sub_bridge - SMILES for bridge units.

NFA_sub_terminal - SMILES for terminal sub units.

Files

dataset.csv

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