3 papers
cond-mat.mtrl-sci2026
Autonomous Optimization of Complex Oxides for Thermochemical Fuel Production
Shuiping Gong, Mingcheng Li, Han Hao +13
Two-step thermochemical fuel production, including H2O and CO2 splitting, offers a promising route to sustainable fuel manufacturing, with performance governed by redox-active oxid…
cond-mat.mtrl-sci2026
Mechanism-Dependent Descriptors Enable Predictive Design of Oxygen Capacity in Perovskite Oxides
Shuiping Gong, Yi Li, Jie Su +9
Perovskite oxides can reversibly accommodate substantial changes in oxygen stoichiometry, making them attractive for clean-energy technologies including chemical looping and oxygen…
cond-mat.mtrl-sci2026
Interpretable Nanoporous Materials Design with Symmetry-Aware Networks
Zhenhao Zhou, Salman Bin Kashif, Jin-Hu Dou +4
Reticular frameworks hold promise for diverse sustainable applications, yet their immense chemical space limits efficient and systematic design. While machine learning provides a c…