相关论文: Hydrogen diffusion in ceria: solid state NMR, comb…

The United States Department of Energy (DOE) has set ambitious targets for hydrogen storage materials for onboard light-duty cars which are to be achieved by 2027. One of the major problems in solid hydrogen storage materials is the…

Molecular dynamics simulations are used to study the mechanism and kinetics of hydrated electron diffusion. The electron center of mass is found to exhibit Brownian-type behavior with a diffusion coefficient considerably greater than that…

We have performed quasielastic and inelastic neutron scattering (QENS and INS) measurements from 300 K to 1173 K to investigate the Na-diffusion and underlying host dynamics in Na2Ti3O7. The QENS data show that the Na atoms undergo…

Deep inelastic neutron scattering experiments using indirect time-of-flight spectrometers have reported a smaller cross section for the hydrogen atom than expected from conventional scattering theory. Typically, at large momentum transfers,…

We study the distribution of hydrogen and various hydride configurations in realistic models of a-Si:H for two different concentration generated via experimentally constrained molecular relaxation approach (ECMR) [1]. The microstructure…

We use {\it ab initio} molecular dynamics simulations to study a sample of liquid silica containing 3.84 wt.% H$_2$O.We find that, for temperatures of 3000 K and 3500 K,water is almost exclusively dissolved as hydroxyl groups, the silica…

Diffusion of atomic and molecular hydrogen in the interstitial space between graphite sheets has been studied by molecular dynamics simulations. Interatomic interactions were modeled by a tight-binding potential fitted to density-functional…

We calculate the scattering rate of low energy neutrinos in hot and dense neutron matter encountered in neutrons stars and supernova in the hydrodynamic regime. We find that the Brillouin peak, associated with the sound mode, and the…

Heavy element and helium diffusion are both included for the first time in this series of papers on precise solar models, along with improvements in the input data for nuclear reaction rates, the solar luminosity, the solar age, heavy…

The kinetics of hydrogen diffusion in C15 cubic and C14 hexagonal TiCr$_2$H$_x$ (0 < $x$ <= 4) Laves-phase hydrogen storage alloys is investigated with density functional theory (DFT) and machine learning interatomic potentials (MLIPs).…

The adsorption properties of isolated H$_{2}$O molecule on stoichiometric and reduced (with on-surface oxygen vacancy) ceria(1111) surfaces at low coverage are theoretically investigated by using density-functional-theory+\emph{U}…

The theoretical analysis of the process of diffusion of interstitial oxygen atoms and hydrogen molecules in silicon and germanium crystals has been performed. The calculated values of the activation energy and pre-exponential factor for an…

The production of energetic neutrons in $ep$ collisions has been studied with the ZEUS detector at HERA. The neutron energy and $p_T^2$ distributions were measured with a forward neutron calorimeter and tracker in a $40 \pb^{-1}$ sample of…

The design of moderators and cold sources of neutrons is a key point in research-reactor physics, requiring extensive knowledge of the scattering properties of very important light molecular liquids such as methane, hydrogen and their…

The diffusion of atoms and radicals on interstellar dust grains is a fundamental ingredient for predicting accurate molecular abundances in astronomical environments. Quantitative values of diffusivity and diffusion barriers usually rely…

We present an inelastic neutron scattering study of liquid and solid hydrogen carried out using the wide Angular Range Chopper Spectrometer at Oak Ridge National Laboratory. From the observed dynamic structure factor, we obtained empirical…

In this paper we present kinetic properties such as migration and decomposition barriers of hydrogen defects in silicon calculated by Density Functional Theory (DFT) based methods. We study the following defects: H atoms (H) and ions (H+,…

A measurement of inclusive charged particle distributions in deep inelastic $ep$ scattering for $\gamma^* p$ centre-of-mass energies $75< W < 175$~GeV and momentum transfer squared $10< Q^2 < 160$~GeV$^2$ from the ZEUS detector at HERA is…

We analyze the experimental data on inelastic neutron scattering by a thin ~5-atomic-layer film of liquid helium at three different temperatures: T=0.4K, 0.98K and 1.3K. These data were partially published previously, but here we present…

Recent results on dijet production in deep-inelastic scattering from the H1 experiment at the ep-collider HERA are presented. Internal jet structure has been studied in terms of jet shapes and subjet multiplicities in the Breit frame. Both…