First principles study and reconsideration of the mechanical and dynamic stability of hydrogen-rich compound cI14-CaH6 high critical temperature superconductor under pressure
Physica C: Superconductivity and its Applications（2021）
Abstract
•Reconsideration in the stability cI14-CaH6 high Tc superconductor using DFT calculations.•Study of mechanical and vibrational properties of cI14-CaH6 under pressure.•Study of the superconductivity and some critical parameters.
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Key words
Superconductivity,Hydrogen-rich mono-metal,Electron-phonon coupling,Density functional theory
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