In this paper we explore whether the quantum oscillation signals recently observed in ortho-II YBa$_2$Cu$_3$O$_{6.5}$ may be explained by conventional density functional band-structure theory. Our calculations show that the Fermi surface of YBa$_2$Cu$_3$O$_{6.5}$ is extremely sensitive to small shifts in the relative positions of the bands. With rigid band shifts of around 30 meV small tubular pockets of Fermi surface develop around the Y point in the Brillouin zone. The cross-sectional areas and band masses of the quantum oscillatory orbits on these pockets are close to those observed. The difference between the bandstructure of YBa$_2$Cu$_3$O$_{6.5}$ and YBa$_2$Cu$_4$O$_{8}$ are discussed.
Nuclear magnetic resonance (NMR) measurements of CuO chains of detwinned Ortho-II YBa$_2$Cu$_3$O$_{6.5}$ (YBCO6.5) single crystals reveal unusual and remarkable properties. The chain Cu resonance broadens significantly, but gradually, on cooling from room temperature. The lineshape and its temperature dependence are substantially different from that of a conventional spin/charge density wave (S/CDW) phase transition. Instead, the line broadening is attributed to small amplitude static spin and charge density oscillations with spatially varying amplitudes connected with the ends of the finite length chains. The influence of this CuO chain phenomenon is also clearly manifested in the plane Cu NMR.
The polarized Raman scattering spectra from freshly cleaved $ab$, $ac$, and $bc$ surfaces of high quality twin free YBa$_2$Cu$_3$O$_{6.5}$ (Ortho-II) single crystals ($T_c$=57.5 K and $Delta T = 0.6$ K) were studied between 80 and 300 K. All eleven $A_g$ Raman modes expected for the Ortho-II structure as well some modes of $B_{2g}$ and $B_{3g}$ symmetry were identified in close comparison with predictions of lattice dynamical calculations. The electronic scattering from the $ab$ planes is strongly anisotropic and decreases between 200 and 100 K within the temperature range of previously reported pseudogap opening. The coupling of phonons to Raman active electronic excitations manifested by asymmetric (Fano) profiles of several modes also decreases in the same range. Among the new findings that distinguish the Raman scattering of Ortho-II from that of Ortho-I phase is the unusual relationship ($alpha_{xx} approx -alpha_{yy}$) between the elements of the Raman tensor of the apex oxygen $A_g$ mode.
The de Haas-van Alphen effect was observed in the underdoped cuprate YBa$_2$Cu$_3$O$_{6.5}$ via a torque technique in pulsed magnetic fields up to 59 T. Above an irreversibility field of $sim$30 T, the magnetization exhibits clear quantum oscillations with a single frequency of 540 T and a cyclotron mass of 1.76 times the free electron mass, in excellent agreement with previously observed Shubnikov-de Haas oscillations. The oscillations obey the standard Lifshitz-Kosevich formula of Fermi-liquid theory. This thermodynamic observation of quantum oscillations confirms the existence of a well-defined, close and coherent, Fermi surface in the pseudogap phase of cuprates.
Optical excitation in the cuprates has been shown to induce transient superconducting correlations above the thermodynamic transition temperature, $T_C$, as evidenced by the terahertz frequency optical properties in the non-equilibrium state. In YBa$_2$Cu$_3$O$_{6+x}$ this phenomenon has so far been associated with the nonlinear excitation of certain lattice modes and the creation of new crystal structures. In other compounds, like La$_{2-x}$Ba$_x$CuO$_4$, similar effects were reported also for excitation at near infrared frequencies, and were interpreted as a signature of the melting of competing orders. However, to date it has not been possible to systematically tune the pump frequency widely in any one compound, to comprehensively compare the frequency dependent photo-susceptibility for this phenomenon. Here, we make use of a newly developed optical parametric amplifier, which generates widely tunable high intensity femtosecond pulses, to excite YBa$_2$Cu$_3$O$_{6.5}$ throughout the entire optical spectrum (3 - 750 THz). In the far-infrared region (3 - 25 THz), signatures of non-equilibrium superconductivity are induced only for excitation of the 16.4 THz and 19.2 THz vibrational modes that drive $c$-axis apical oxygen atomic positions. For higher driving frequencies (25 - 750 THz), a second resonance is observed around the charge transfer band edge at ~350 THz. These observations highlight the importance of coupling to the electronic structure of the CuO$_2$ planes, either mediated by a phonon or by charge transfer.
We measure magnetic quantum oscillations in the underdoped cuprates YBa$_2$Cu$_3$O$_{6+x}$ with $x=0.61$, 0.69, using fields of up to 85 T. The quantum-oscillation frequencies and effective masses obtained suggest that the Fermi energy in the cuprates has a maximum at $papprox 0.11-0.12$. On either side, the effective mass may diverge, possibly due to phase transitions associated with the T=0 limit of the metal-insulator crossover (low-$p$ side), and the postulated topological transition from small to large Fermi surface close to optimal doping (high $p$ side).