Zerendatu OpenAire honen arabera: egilea"Dangić, Đorđe"
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Ab initio study of the structural, vibrational, and optical properties of potential parent structures of nitrogen-doped lutetium hydride
Dangic, Dorde; García Goiricelaya, Peio; Fang, Yue-Wen; Ibañez Azpiroz, Julen; Errea Lope, Ion
(APS, 2023-08-28)
The recent report of near-ambient conditions superconductivity in a nitrogen-doped lutetium hydride has inspired a large number of experimental studies with contradictory results. We model from first principles the physical ... -
Assessing the feasibility of near-ambient conditions superconductivity in the Lu-N- H system
The report of near-ambient superconductivity in nitrogen-doped lutetium hydrides (Lu-N-H) has generated a great interest. However, conflicting results raised doubts regarding superconductivity. Here, we combine high-throughput ... -
Large impact of phonon lineshapes on the superconductivity of solid hydrogen
Dangic, Dorde; Monacelli, Lorenzo; Bianco, Raffaello; Mauri, Francesco; Errea Lope, Ion
(Springer Nature, 2024-05-09)
Phonon anharmonicity plays a crucial role in determining the stability and vibrational properties of high-pressure hydrides. Furthermore, strong anharmonicity can render phonon quasiparticle picture obsolete questioning ...