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Strong-coupling character of superconducting phase in compressed selenium hydride

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 Added by Ewa Drzazga Mrs
 Publication date 2020
  fields Physics
and research's language is English




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At present, metal hydrides are considered highly promising materials for phonon-mediated superconductors, that exhibit high values of the critical temperature. In the present study, the superconducting properties of the compressed selenium hydride in its simplest form (HSe) are analyzed, toward quantitative characterization of this phase. By using the state-of-art Migdal-Eliashberg formalism, it is shown that the critical temperature in this material is relatively high ($T_{c}$=42.65 K) and surpass the level of magnesium diboride superconductor, assuming that the Coulomb pseudopotential takes value of $0.1$. Moreover, the employed theoretical model allows us to characterize other pivotal thermodynamic properties such as the superconducting band gap, the free energy, the specific heat and the critical magnetic field. In what follows, it is shown that the characteristic thermodynamic ratios for the aforementioned parameters differ from the predictions of the Bardeen-Cooper-Schrieffer theory. As a result, we argue that strong-coupling and retardation effects play important role in the discussed superconducting state, which cannot be described within the weak-coupling regime.



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At present, hydrogen-based compounds constitute one of the most promising classes of materials for applications as a phonon-mediated high-temperature superconductors. Herein, the behavior of the superconducting phase in tellurium hydride (HTe) at high pressure ($p=300$ GPa) is analyzed in details, by using the isotropic Migdal-Eliashberg equations. The chosen pressure conditions are considered here as a case study which corresponds to the highest critical temperature value ($T_{c}$) in the analyzed material, as determined within recent density functional theory simulations. It is found that the Migdal-Eliashberg formalism, which constitutes a strong-coupling generalization of the Bardeen-Cooper-Schrieffer (BCS) theory, predicts that the critical temperature value ($T_{c}=52.73$ K) is higher than previous estimates of the McMillan formula. Further investigations show that the characteristic dimensionless ratios for the the thermodynamic critical field, the specific heat for the superconducting state, and the superconducting band gap exceeds the limits of the BCS theory. In this context, also the effective electron mass is not equal to the bare electron mass as provided by the BCS theory. On the basis of these findings it is predicted that the strong-coupling and retardation effects play pivotal role in the superconducting phase of HTe at 300 GPa, in agreement with similar theoretical estimates for the sibling hydrogen and hydrogen-based compounds. Hence, it is suggested that the superconducting state in HTe cannot be properly described within the mean-field picture of the BCS theory.
This article reports the experimentally clarified crystal structure of a recently discovered sulfur hydride in high temperature superconducting phase which has the highest critical temperature Tc over 200 K which has been ever reported. For understanding the mechanism of the high superconductivity, the information of its crystal structure is very essential. Herein we have carried out the simultaneous measurements electrical resistance and synchrotron x-ray diffraction under high pressure, and clearly revealed that the hydrogen sulfide, H2S, decomposes to H3S and its crystal structure has body-centered cubic symmetry in the superconducting phase.
Recently, the discovery of room-temperature superconductivity (SC) was experimentally realized in the fcc phase of LaH$_{10}$ under megabar pressure. Specifically, the isotope effect of $T_{rm c}$ was measured by the replacement of hydrogen (H) with deuterium (D), demonstrating a driving role of phonons in the observed room-temperature SC. Herein, based on the first-principles calculations within the harmonic approximation, we reveal that (i) the identical electron-phonon coupling constants of fcc LaH$_{10}$ and LaD$_{10}$ decrease monotonously with increasing pressure and (ii) the isotope effect of $T_{rm c}$ is nearly proportional to $M^{-{alpha}}$ ($M$: ionic mass) with ${alpha}$ ${approx}$ 0.465, irrespective of pressure. The predicted value of ${alpha}$ agrees well with the experimental one (${alpha}=0.46$) measured at around 150 GPa. Thus, our findings provide a theoretical confirmation of the conventional electron-phonon coupling mechanism in a newly discovered room-temperature superconductor of compressed LaH$_{10}$.
The discovery of superconductivity at 200 K in the hydrogen sulfide system at large pressures [1] was a clear demonstration that hydrogen-rich materials can be high-temperature superconductors. The recent synthesis of LaH$_{10}$ with a superconducting critical temperature (T$_{text{c}}$) of 250 K [2,3] places these materials at the verge of reaching the long-dreamed room-temperature superconductivity. Electrical and x-ray diffraction measurements determined a weakly pressure-dependent T$_{text{c}}$ for LaH$_{10}$ between 137 and 218 gigapascals in a structure with a face-centered cubic (fcc) arrangement of La atoms [3]. Here we show that quantum atomic fluctuations stabilize in all this pressure range a high-symmetry Fm-3m crystal structure consistent with experiments, which has a colossal electron-phonon coupling of $lambdasim3.5$. Even if ab initio classical calculations neglecting quantum atomic vibrations predict this structure to distort below 230 GPa yielding a complex energy landscape with many local minima, the inclusion of quantum effects simplifies the energy landscape evidencing the Fm-3m as the true ground state. The agreement between the calculated and experimental T$_{text{c}}$ values further supports this phase as responsible for the 250 K superconductivity. The relevance of quantum fluctuations in the energy landscape found here questions many of the crystal structure predictions made for hydrides within a classical approach that at the moment guide the experimental quest for room-temperature superconductivity [4,5,6]. Furthermore, quantum effects reveal crucial to sustain solids with extraordinary electron-phonon coupling that may otherwise be unstable [7].
338 - U. Welp , R. Xie , A. E. Koshelev 2008
We present a thermodynamic study of the phase diagram of single-crystal Ba1-xKxFe2As2 using specific heat measurements. In zero-magnetic field a clear step in the heat capacity of deltaC/Tc = 0.1 J/f.u.K2 is observed at Tc = 34.6K for a sample with x = 0.4. This material is characterized by extraordinarily high slopes of the upper critical field of dHc2,c/dT= -6.5 T/K and dHc2,ab/dT= -17.4 T/K and a surprisingly low anisotropy of gamma ~ 2.6 near Tc. A consequence of the large field scale is the effective suppression of superconducting fluctuations. Using thermodynamic relations we determine Ginzburg-Landau parameters of kappac ~ 100 and kappaab ~ 260 identifying Ba1-xKxFe2As2 as extreme type-II. The large value of the normalized discontinuity of the slopes of the specific heat at Tc, (Tc/deltaC)times delta(dC/dT)~ 6 indicates strong coupling effects in Ba1-xKxFe2As2.
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