A database of refractive indices and dielectric constants auto-generated using ChemDataExtractor

Zhao, Jiuyang; Cole, Jacqueline M.

doi:10.1038/s41597-022-01295-5

A database of refractive indices and dielectric constants auto-generated using ChemDataExtractor

Journal Article · Tue May 03 00:00:00 EDT 2022 · Scientific Data

DOI:https://doi.org/10.1038/s41597-022-01295-5· OSTI ID:1982166

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Univ. of Cambridge (United Kingdom). Cavendish Lab.
Univ. of Cambridge (United Kingdom). Cavendish Lab.; Science and Technology Facilities Council (STFC), Oxford (United Kingdom). Rutherford Appleton Lab., ISIS Neutron and Muon Source

The ability to auto-generate databases of optical properties holds great potential for advancing optical research, especially with regards to the data-driven discovery of optical materials. An optical property database of refractive indices and dielectric constants is presented, which comprises a total of 49,076 refractive index and 60,804 dielectric constant data records on 11,054 unique chemicals. The database was auto-generated using the state-of-the-art natural language processing software, ChemDataExtractor, using a corpus of 388,461 scientific papers. The data repository offers a representative overview of the information on linear optical properties that resides in scientific papers from the past 30 years. Public availability of these data will enable a quick search for the optical property of certain materials. The large size of this repository will accelerate data-driven research on the design and prediction of optical materials and their properties. To the best of our knowledge, this is the first auto-generated database of optical properties from a large number of scientific papers. We provide a web interface to aid the use of our database.

View Accepted Manuscript (DOE)

Research Organization:: Argonne National Laboratory (ANL), Argonne, IL (United States). Argonne Leadership Computing Facility (ALCF)

Sponsoring Organization:: Science and Technology Facilities Council (STFC); USDOE Office of Science (SC), Basic Energy Sciences (BES). Scientific User Facilities (SUF)

Grant/Contract Number:: AC02-06CH11357

OSTI ID:: 1982166

Journal Information:: Scientific Data, Journal Name: Scientific Data Journal Issue: 1 Vol. 9; ISSN 2052-4463

Publisher:: Nature Publishing GroupCopyright Statement

Country of Publication:: United States

Language:: English

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