With about two-thirds of all used energy being lost as waste heat, there is a compelling need for high-performance thermoelectric materials that can directly and reversibly convert heat to electrical energy. However, the practical realization of thermoelectric materials is limited by their hitherto low figure of merit, ZT, which governs the Carnot efficiency according to the second law of thermodynamics. The recent successful strategy of nanostructuring to reduce thermal conductivity has achieved record-high ZT values in the range 1.5-1.8 at 750-900 kelvin, but still falls short of the generally desired threshold value of 2. Nanostructures in bulk thermoelectrics allow effective phonon scattering of a significant portion of the phonon spectrum, but phonons with long mean free paths remain largely unaffected. Here we show that heat-carrying phonons with long mean free paths can be scattered by controlling and fine-tuning the mesoscale architecture of nanostructured thermoelectric materials. Thus, by considering sources of scattering on all relevant length scales in a hierarchical fashion--from atomic-scale lattice disorder and nanoscale endotaxial precipitates to mesoscale grain boundaries--we achieve the maximum reduction in lattice thermal conductivity and a large enhancement in the thermoelectric performance of PbTe. By taking such a panoscopic approach to the scattering of heat-carrying phonons across integrated length scales, we go beyond nanostructuring and demonstrate a ZT value of ∼2.2 at 915 kelvin in p-type PbTe endotaxially nanostructured with SrTe at a concentration of 4 mole per cent and mesostructured with powder processing and spark plasma sintering. This increase in ZT beyond the threshold of 2 highlights the role of, and need for, multiscale hierarchical architecture in controlling phonon scattering in bulk thermoelectrics, and offers a realistic prospect of the recovery of a significant portion of waste heat.

The three-dimensional (3D) atom-probe technique produces a reconstruction of the elemental chemical identities and three-dimensional positions of atoms field evaporated from a sharply pointed metal specimen, with a local radius of curvature of less than 50 nm. The number of atoms collected can be on the order of one million, representing an analysis volume of approximately 20 nm × 20 nm × 200 nm (80,000 nm3). This large amount of data allows for the identification of microstructural features in a sample, such as grain or heterophase boundaries, if the feature density is large enough. Correlation of the measured atomic positions with these identified features results in an atom-by-atom description of the chemical environment of crystallographic defects. This article outlines a data compilation technique for the generation of composition profiles in the vicinity of interfaces in a geometrically independent way. This approach is applied to quantitative determination of interfacial segregation of silver at a MgO/Cu(Ag) heterophase interface.

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We describe four criteria for the selection of alloying elements capable of producing castable, precipitationstrengthened Al alloys with high-temperature stability and strength: these alloying elements must (i) be capable of forming a suitable strengthening phase, (ii) show low solid solubility in Al, (iii) low diffusivity in Al, and (iv) retain the ability for the alloy to be conventionally solidified. With regard to criterion (i), we consider those systems forming Al 3 M trialuminide compounds with a cubic L1 2 crystal structure, which are chemically and structurally analogous to Ni 3 Al in the Ni-based superalloys. Eight elements, clustered in the same region of the periodic table, fulfill criterion (i): the first Group 3 transition metal (Sc), the three Group 4 transition metals (Ti, Zr, Hf) and the four latest lanthanide elements (Er, Tm, Yb, Lu). Based on a review of the existing literature, these elements are assessed in terms of criteria (ii) and (iii), which satisfy the need for a dispersion in Al with slow coarsening kinetics, and criterion (iv), which is discussed based on the binary phase diagrams.

Abstract-Precipitation of the Al 3 Sc (L1 2 ) phase in aluminum alloys, containing 0.1, 0.2 or 0.3 wt% Sc, is studied with conventional transmission and high-resolution (HREM) electron microscopies. The exact morphologies of the Al 3 Sc precipitates were determined for the first time by HREM, in Al-0.1 wt% Sc and Al-0.3 wt% Sc alloys. The experimentally determined equilibrium shape of the Al 3 Sc precipitates, at 300°C and 0.3 wt% Sc, has 26 facets, which are the 6 {100} (cube), 12 {110} (rhombic dodecahedron), and 8 {111} (octahedron) planes, a Great Rhombicuboctahedron. This equilibrium morphology had been predicted by first principles calculations of the pertinent interfacial energies. The coarsening kinetics obey the (time) 1/3 kinetic law of Lifshitz-Slyozov-Wagner theory and they yield an activation energy for diffusion, 164±9 kJ/mol, that is in agreement with the values obtained from tracer diffusion measurements of Sc in Al and first principles calculations, which implies diffusion-controlled coarsening. 