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cond-mat.mtrl-sci2019
The pseudopotential approach within density-functional theory: the case of atomic metallic hydrogen
Jin Zhang, Jeffrey M. McMahon
Internal energies, enthalpies, phonon dispersion curves, and superconductivity of atomic metallic hydrogen are calculated. The (standard) use pseudopotentials in density-functional…
cond-mat.mtrl-sci2019★ 30 cited
High-Temperature Superconductivity in the Ti--H System at High Pressures
Jin Zhang, Jeffrey M. McMahon, Artem R. Oganov +4
Search for stable high-pressure compounds in the Ti--H system reveals the existence of titanium hydrides with new stoichiometries, including Ibam-TiH, I4/m-TiH,…