Gunnar K. Pálsson

Thermoelectric Response Near the Density Driven Mott Transition

We investigate the thermoelectric response of correlated electron systems near the density driven Mott transition using the dynamical mean field theory.

Using light transmission to watch hydrogen diffuse

Because of its light weight and small size, hydrogen exhibits one of the fastest diffusion rates in solid materials, comparable to the diffusion rate of liquid water molecules at room temperature. The diffusion rate is determined by an intricate combination of quantum effects and dynamic interplay with the displacement of host atoms that is still only partially understood. Here we present direct observations of the spatial and temporal changes in the diffusion-induced concentration profiles in a vanadium single crystal and we show that the results represent the experimental counterpart of the full time and spatial solution of Ficks diffusion equation. We validate the approach by determining the diffusion rate of hydrogen in a single crystal vanadium (001) film, with net diffusion in the [110] direction.

Hydrogen site occupancy and strength of forces in nanosized metal hydrides

The dipole force components in nanosized metal hydrides are quantitatively determined with curvature and x-ray diffraction measurements. Ab initio density functional theory is used to calculate the dipole components and the symmetry of the strain field. The hydrogen occupancy in a 100-nm-thick V film is shown to be tetrahedral with a slight asymmetry at low concentration, and a transition to octahedral occupancy is shown to take place at around 0.07 [H/V] at 360 K. When the thickness of the V layer is reduced to 3 nm and biaxially strained, in a Fe0.5V0.5/V superlattice, the hydrogen unequivocally occupies octahedral z-like sites, even at and below concentrations of 0.02 [H/V].

Recent upgrade of the polarized neutron reflectometer Super ADAM

The Super ADAM reflectometer—a part of Collaborative Research Group at ILL—is modern competitive neutron research platform which is destined primarily for Swedish use (70% of total beam time). Supe...

Experimental observation of hysteresis in a coherent metal-hydride phase transition

We investigate the hysteresis obtained in the hydrogen absorption and desorption cycle for a single crystal [Formula: see text] superlattice. Below the critical temperature, a small but clear hysteresis is observed in the pressure-composition isotherms, while it is absent above. The experimental results thereby prove the relevance of macroscopic energy barriers for obtaining hysteresis in coherent structural transformations. The textured Pd layer exhibits substantially larger hysteresis effects, which can be related to an irreversible energy loss caused by defect generation in Pd.

Concentration dependence of hydrogen diffusion in clamped vanadium (0 0 1) films

The chemical diffusion coefficient of hydrogen in a 50 nm thin film of vanadium (0 0 1) is measured as a function of concentration and temperature, well above the known phase boundaries. Arrhenius analysis of the tracer diffusion constants reveal large changes in the activation energy with concentration: from 0.10 at 0.05 in H V-1 to 0.5 eV at 0.2 in H V-1. The results are consistent with a change from tetrahedral to octahedral site occupancy, in that concentration range. The change in site occupancy is argued to be caused by the uniaxial expansion of the film originating from the combined hydrogen induced expansion and the clamping of the film to the substrate.