Bibliographic Details
| Title: |
Physical descriptor for the Gibbs energy of inorganic crystalline solids and temperature-dependent materials chemistry |
| Authors: |
Christopher J. Bartel, Samantha L. Millican, Ann M. Deml, John R. Rumptz, William Tumas, Alan W. Weimer, Stephan Lany, Vladan Stevanović, Charles B. Musgrave, Aaron M. Holder |
| Source: |
Nature Communications, Vol 9, Iss 1, Pp 1-10 (2018) |
| Publisher Information: |
Nature Portfolio, 2018. |
| Publication Year: |
2018 |
| Collection: |
LCC:Science |
| Subject Terms: |
Science |
| More Details: |
Materials databases currently neglect the temperature effect on compound thermodynamics. Here the authors introduce a Gibbs energy descriptor enabling the high-throughput prediction of temperature-dependent thermodynamics across a wide range of compositions and temperatures for inorganic solids. |
| Document Type: |
article |
| File Description: |
electronic resource |
| Language: |
English |
| ISSN: |
2041-1723 |
| Relation: |
https://doaj.org/toc/2041-1723 |
| DOI: |
10.1038/s41467-018-06682-4 |
| Access URL: |
https://doaj.org/article/a4f6f48441e84528b5fb49293d022637 |
| Accession Number: |
edsdoj.4f6f48441e84528b5fb49293d022637 |
| Database: |
Directory of Open Access Journals |
