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cond-mat.mtrl-sci2024
Quantum Anharmonic Effects on the Superconductivity of I-43m CH4-H3S at High Pressures: a First-Principles Study
Pugeng Hou, Francesco Belli, Tiange Bi +2
Making use of first-principles calculations we analyze the effect of quantum ionic fluctuations and lattice anharmonicity on the crystal structure and superconductivity of I-43m CH…
cond-mat.mtrl-sci2024
Significant Impact of Quantum and Anharmonic Effects on the Structural Stability and Superconductivity of NbH3 at High Pressures
Pugeng Hou, Yao Ma, Hui Xie +5
First-principles calculations combined with the stochastic self-consistent harmonic approximation reveal significant effects of the quantum ionic fluctuations and lattice anharmoni…