| 摘要 |
<p>A process is disclosed for identifying the solubilities of hydrogen or its isotopes in selected materials of single or multiple element constituents. The process tabulates the solubilities for an evaluation set having a range of material constituent concentrations. The solubility of hydrogen is established in a computer program which solves the Schrödinger wave equations using the Xα scattered wave approach to achieve plots of the electron orbital energy levels for the material and its constituents. The material constituent concentration, in an evaluation set, that has those d level orbitals that contain the Fermi level aligned with the 1s orbital of hydrogen, or its isotope, is selected as the material with the optimal solubility. Such a material has utility in hydrogen storage for fuel cells, for other applications using hydrogen from a recyclable supply, and in electrical battery technology.</p> |
