John Roszell

Effect of Temperature on the Desorption of Lithium from Molybdenum(110) Surfaces: Implications for Fusion Reactor First Wall Materials

Determining the strength of Li binding to Mo is critical to assessing the survivability of Li as a potential first wall material in fusion reactors. We present the results of a joint experimental and theoretical investigation into how Li desorbs from Mo(110) surfaces, based on what can be deduced from temperature-programmed desorption measurements and density functional theory (DFT). Li desorption peaks measured at temperatures ranging from 711 K (1 monolayer, ML) to 1030 K (0.04 ML), with corresponding desorption onsets from 489 to 878 K, follow a trend similar to predicted Gibbs free energies for Li adsorption. Bader charge analysis of DFT densities reveals that repulsive forces between neighboring positively charged Li atoms increase with coverage and thus reduce the bond strength between Mo and Li, thereby lowering the desorption temperature as the coverage increases. Additionally, DFT predicts that Li desorbs at higher temperatures from a surface with vacancies than from a perfect surface, offering an explanation for the anomalously high desorption temperatures for the last Li to desorb from Mo(110). Analysis of simulated local densities of states indicates that the stronger binding to the defective surface is correlated with enhanced interaction between Li and Mo, involving the Li 2s electrons and not only the Mo 4d electrons as in the case of the pristine surface, but also the Mo 5s electrons in the case with surface vacancies. We suggest that steps and kinks present on the Mo(110) surface behave similarly and contribute to the high desorption temperatures. These findings imply that roughened Mo surfaces may strengthen Li film adhesion at higher temperatures.

Lithium wetting of stainless steel studied via scanning auger microscopy

We are applying a Scanning Auger Microprobe (SAM) to study the growth of lithium films on stainless steel substrates. A small (mm-scale) amount of metallic lithium is applied to a stainless steel surface in a oxygen-free glove box and transferred to the antechamber of the SAM. Native impurities on the stainless steel and lithium surfaces are removed by Ar+ ion sputtering with the SAM ion beam and the surface composition measured by spatially resolved AES. After etching with the ion beam, the AES spectrum from stainless steel adjacent to the lithium showed the Li 50 eV AES line, indicating that surface diffusion of lithium onto the etched stainless steel surface had taken place at room temperature (i.e. well below the 181°C Li melting temperature). The speed of Li spreading on stainless steel under various surface conditions will be reported.