Zobrazeno 1 - 4
of 4
pro vyhledávání: '"Ryan J. Morelock"'
Publikováno v:
Scientific Data, Vol 10, Iss 1, Pp 1-10 (2023)
Abstract Perovskite oxides (ternary chemical formula ABO3) are a diverse class of materials with applications including heterogeneous catalysis, solid-oxide fuel cells, thermochemical conversion, and oxygen transport membranes. However, their multico
Externí odkaz:
https://doaj.org/article/d4858305d5c6454784b07b3394d11587
Autor:
James Eujin Park, Zachary J. L. Bare, Ryan J. Morelock, Mark A. Rodriguez, Andrea Ambrosini, Charles B. Musgrave, Anthony H. McDaniel, Eric N. Coker
Publikováno v:
Frontiers in Energy Research, Vol 9 (2021)
Solar thermochemical hydrogen (STCH) production is a promising method to generate carbon neutral fuels by splitting water utilizing metal oxide materials and concentrated solar energy. The discovery of materials with enhanced water-splitting performa
Externí odkaz:
https://doaj.org/article/c6c20e8835c34b17a3afbd539a3aab37
Publikováno v:
Journal of Chemical Theory and Computation. 18:3257-3267
We report a bond-valence method (BVM) parameterization framework that captures density functional theory (DFT)-computed relative stabilities using the BVM global instability index (GII). We benchmarked our framework against a dataset of 188 experimen
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::7d8e7ac1586966334e0694fbffaee63b
https://doi.org/10.1021/acs.jctc.1c01113
https://doi.org/10.1021/acs.jctc.1c01113
Publikováno v:
Advanced Functional Materials. 32:2200201
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::9c39f69cc2f078224810bc0110f85c80
https://doi.org/10.1002/adfm.202200201
https://doi.org/10.1002/adfm.202200201