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. 2025 Feb 7;28(3):111969. doi: 10.1016/j.isci.2025.111969

Table 1.

The calculated EPC parameter λ, the first moment of Eliashberg function ω, square root of the average square phonon frequencies ω21/2, logarithmic average frequency ωlog, DOS at Fermi level, and superconducting critical temperature Tc for MgP2H14, LiP2H14, BeP2H14, and NaP2H14 under pressure, Tc is obtained from solving the Allen-Dynes modified McMillan equation (herein, we default f1f2 = 1 when λ < 1) and isotropic Migdal Eliashberg equations, with the typical Coulomb pseudopotential μ = 0.10

System P
λ
ω
ω21/2
ωlog
N(Ef)
TcAD
f1f2TcAD
TcME
Reference
(GPa) (K) (K) (K) (states/Ry/fu) (K) (K) (K)
MgP2H14 280 1.65 1281 1481 1072 6.43 133 154 166 this work
350 1.12 1691 1870 1464 6.43 120 130 this work
400 1.02 1840 2030 1578 6.54 114 122 this work
NaP2H14 400 1.45 1101 6.28 139 159 Ref.10
BeP2H14 400 1.13 978 5.73 90 99 Ref.10
LiP2H14 400 0.85 1494 4.96 84 90 Ref.10
300 1.06 1350 5.48 112 125 Ref.10
230 1.69 956 6.08 143 169 Ref.10