[G] 水素・電池関連材料(1)

[230] Assessing Enthalpy for AB2-Type High-Entropy Hydrogen Storage Materials Using Machine Learning and Comparison with Experiments and DFT Calculations

*DANGWAL Shivam^1,2、IKEDA Yuji³、GRABOWSKI Blazej³、EDALATI Kaveh^1,2 (1. WPI-I2CNER, Kyushu University, Fukuoka, Japan、2. The Department of Automotive Science, Kyushu University, Fukuoka, Japan、3. Institute for Materials Science, University of Stuttgart, Germany)

キーワード：Solid-state hydrogen storage、High entropy alloy、DFT、Machine learning、AB2-type

In this study, enthalpy for (solid-state hydrogen storage) hydride formation for a high-entropy alloy was assessed using experiments, machine learning and density function theory.