Electrochemical Evaluation of LaNi_(5–x)Ge_x Metal Hydride Alloys

We report a detailed evaluation of Ge-substituted LaNi_5 for electrochemical application as a negative electrode in alkaline rechargeable cells. Alloys with small substitutions of Ge for Ni show operating pressures, chargeability, cyclic lifetime, and kinetics for hydrogen absorption and desorption all superior to those found in many other substituted LaNi_5 alloys. These improved properties were achieved with a minimal reduction in hydrogen storage capacity

Electrochemical Studies on LaNi5–xSnx Metal Hydride Alloys

Electrochemical studies were performed on LaNi5–xSnx with 0 <= x <= 0.5. We measured the effect of the Sn substituent on the kinetics of charge-transfer and diffusion during hydrogen absorption and desorption, and the cyclic lifetimes of LaNi5–-xSnx electrodes in 250 mAh laboratory test cells. We report beneficial effects of making small substitutions of Sn for Ni in LaNi5 on the performance of the metal hydride alloy anode in terms of cyclic lifetime, capacity, and kinetics. The optimal concentration of Sn in LaNi5–xSnx alloys for negative electrodes in alkaline rechargeable secondary cells was found to lie in the range 0.25 <= x <= 0.3

Electrochemical Properties of LaNi5–xGex Alloys in Ni-MH Batteries

Electrochemical studies were performed on LaNi5–xGex metal hydride alloys with 0 <= x <= 0.5. We carried out single-electrode studies to understand the effects of the Ge substituent on the hydrogen absorption characteristics, the electrochemical capacity, and the electrochemical kinetics of hydrogen absorption and desorption. The electrochemical characteristics of the Ge-substituted alloys are compared to those of the Sn-substituted alloys reported earlier. LaNi5–xGex alloys show compositional trends similar to LaNi5–xSnx alloys, but unlike the Sn-substituted alloys, Ge-substituted alloys continue to exhibit facile kinetics for hydrogen absorption/desorption at high solute concentrations. Cycle lives of LaNi5–xGex electrodes were measured in 300 mAh laboratory test cells and were found to be superior to the Sn-substituted LaNi5 and comparable to a Mm(Ni,Co,Mn,Al)5 alloy. The optimum Ge content for LaNi5–xGex metal hydride alloys in alkaline rechargeable cells is in the range 0.4 <= x <= 0.5

Kinetic distance and kinetic maps from molecular dynamics simulation

Characterizing macromolecular kinetics from molecular dynamics (MD) simulations requires a distance metric that can distinguish slowly-interconverting states. Here we build upon diffusion map theory and define a kinetic distance for irreducible Markov processes that quantifies how slowly molecular conformations interconvert. The kinetic distance can be computed given a model that approximates the eigenvalues and eigenvectors (reaction coordinates) of the MD Markov operator. Here we employ the time-lagged independent component analysis (TICA). The TICA components can be scaled to provide a kinetic map in which the Euclidean distance corresponds to the kinetic distance. As a result, the question of how many TICA dimensions should be kept in a dimensionality reduction approach becomes obsolete, and one parameter less needs to be specified in the kinetic model construction. We demonstrate the approach using TICA and Markov state model (MSM) analyses for illustrative models, protein conformation dynamics in bovine pancreatic trypsin inhibitor and protein-inhibitor association in trypsin and benzamidine

Hydrogen desorption and adsorption measurements on graphite nanofibers

Graphite nanofibers were synthesized and their hydrogen desorption and adsorption properties are reported for 77 and 300 K. Catalysts were made by several different methods including chemical routes, mechanical alloying, and gas condensation. The nanofibers were grown by passing ethylene and H2 gases over the catalysts at 600 °C. Hydrogen desorption and adsorption were measured using a volumetric analysis Sieverts' apparatus, and the graphite nanofibers were characterized by transmission electron microscopy and Brunauer–Emmett–Teller surface area analysis. The absolute level of hydrogen desorption measured from these materials was typically less than the 0.01 H/C atom, comparable to other forms of carbon

The effects of electropulsing on metallic materials

The influence of electropulsing on metallic materials is reviewed, with a focus on phase transformations and grain refinement. While a large and growing body of literature exists on the topic of electropulsing, the mechanisms governing the process are not currently fully understood. Furthermore, the effects of electropulsing on microstructure and mechanical properties are not yet clearly defined. This review seeks to summarise the existing literature in order to highlight and understand research trends across a variety of metals and alloys, and to clarify the state of the art. Research has shown that the electropulsing process is capable of inducing low temperature recrystallisation in metallic materials at an accelerated rate compared to more traditional heat treatment methods. These microstructural changes often alter the mechanical properties of the materials such as ductility, tensile strength and hardness. Crack healing as a result of electropulsing treatment has also been observed in damaged or work hardened materials and pre-deformation of the sample has been shown to enhance the effects of electropulsing

Scaling Behavior of the Landau Gauge Overlap Quark Propagator

The properties of the momentum space quark propagator in Landau gauge are examined for the overlap quark action in quenched lattice QCD. Numerical calculations are done on three lattices with different lattice spacings and similar physical volumes to explore the approach of the quark propagator towards the continuum limit. We have calculated the nonperturbative momentum-dependent wavefunction renormalization function $Z(p^2)$ and the nonperturbative mass function $M(p^2)$ for a variety of bare quark masses and extrapolate to the chiral limit. We find the behavior of $Z(p^2)$ and $M(p^2)$ are in good agreement for the two finer lattices in the chiral limit. The quark condensate is also calculated.Comment: 3 pages, Lattice2003(Chiral fermions

Scaling behavior of quark propagator in full QCD

We study the scaling behavior of the quark propagator on two lattices with similar physical volume in Landau gauge with 2+1 flavors of dynamical quarks in order to test whether we are close to the continuum limit for these lattices. We use configurations generated with an improved staggered (``Asqtad'') action by the MILC collaboration. The calculations are performed on $28^3\times 96$ lattices with lattice spacing $a = 0.09$ fm and on $20^3\times 64$ lattices with lattice spacing $a = 0.12$ fm. We calculate the quark mass function, $M(q^2)$, and the wave-function renormalization function, $Z(q^2)$, for a variety of bare quark masses. Comparing the behavior of these functions on the two sets of lattices we find that both $Z(q^2)$ and $M(q^2)$ show little sensitivity to the ultraviolet cutoff.Comment: 6 pages, 5 figure