Observation of two critical points linked to the high field phase B in CeCu2Si2

We present thermal expansion and magnetostriction measurements on a CeCu2Si2 single crystal of A/S-type up to 17.9T magnetic field applied along the crystallographic a-direction (Delta L ll a ll H) and down to 0.015K temperature. We identify clear thermodynamic anomalies at the superconducting transition T_c and at two second order transitions T_A,B into ordered phases A and B. Our measurements establish for the first time the boundary of phase B at high field and low temperature. No evidence for additional high field phases above B is found up to the maximum field. We speculate based on our experimental results that i) phase B is similar to phase A of spin-density wave type and ii) the first order phase transition between A and B is caused by Fermi surface reconstruction. We furthermore identify a new quantum critical point at H_c ~ 17T, where T_B is suppresssed to zero, and a bicritical point at (0.35K, 7.0T), where phase lines T_A(H) and T_B(H) meet

Phononic filter effect of rattling phonons in the thermoelectric clathrate Ba8_8Ge40+x_{40+x}Ni6−x_{6-x}

One of the key requirements for good thermoelectric materials is a low lattice thermal conductivity. Here we present a combined neutron scattering and theoretical investigation of the lattice dynamics in the type I clathrate system Ba-Ge-Ni, which fulfills this requirement. We observe a strong hybridization between phonons of the Ba guest atoms and acoustic phonons of the Ge-Ni host structure over a wide region of the Brillouin zone which is in contrast with the frequently adopted picture of isolated Ba atoms in Ge-Ni host cages. It occurs without a strong decrease of the acoustic phonon lifetime which contradicts the usual assumption of strong anharmonic phonon--phonon scattering processes. Within the framework of ab-intio density functional theory calculations we interpret these hybridizations as a series of an ti-crossings which act as a low pass filter, preventing the propagation of acoustic phonons. To highlight the effect of such a phononic low pass filter on the thermal transport, we compute the contribution of acoustic phonons to the thermal conductivity of Ba$_8$Ge$_{40}$Ni$_{6}$ and compare it to those of pure Ge and a Ge$_{46}$ empty-cage model system.Comment: 10 pages, 10 figure

Low-temperature structural investigations of the frustrated quantum antiferromagnets Cs2CuCl(4-x)Br(x)

Powder X-ray diffraction (PXRD) and single-crystal neutron scattering were used to study in detail the structural properties of the Cs2CuCl(4-x)Br(x) series, good realizations of layered triangular antiferromagnets. Detailed temperature-dependent PXRD reveal a pronounced anisotropy of the thermal expansion for the three different crystal directions of the orthorhombic structure without any structural phase transition down to 20 K. Remarkably, the anisotropy of the thermal expansion varies for different $x$, leading to distinct changes of the geometry of the local Cu environment as a function of temperature and composition. The refinement of the atomic positions confirms that for x=1 and 2, the Br atoms occupy distinct halogen sites in the [CuX4]-tetrahedra (X = Cl, Br). The precise structure data are used to calculate the magnetic exchange couplings using density functional methods for x=0. We observe a pronounced temperature dependence of the calculated magnetic exchange couplings, reflected in the strong sensitivity of the magnetic exchange couplings on structural details. These calculations are in good agreement with the experimentally established values for Cs2CuCl4 if one takes the low-temperature structure data as a starting point