Electronic, redox, and optical property prediction of organic π-conjugated molecules through a hierarchy of machine learning approaches
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下载链接：
https://www.materialsdatafacility.org/detail/ocelotml_2d_v1.2
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资源简介：
Trained machine learning models on the [ocelot_chromophore_v1 dataset](https://acdc.alcf.anl.gov/mdf/detail/ocelot_chromophore_v1_v1.1/).
提供机构：
Materials Data Facility
创建时间：
2022-12-16
