Studying diffusion mechanism

Wood, an environmentally friendly construction material, is characterized by a critical attribute that significantly influences its mechanical properties and durability: its moisture absorption behavior. This study expands upon an existing one-dimensional model to develop an innovative two-dimensional numerical framework for simulating moisture propagation within wood.

15p vibecca 01-10-2024 2 0   Download

The simulation finds a large number of vacancy-simplexes, which plays a role of diffusion vehicle for cobalt atom and varies with relaxation degree. A new diffusion mechanism for tracer diffusivity in cobalt amorphous solid is supposed as follows: The elemental atomic movement includes a jump of neighbouring atoms into the vacancy-simplexes and then collective displacement of a large number of atoms.

9p larachdumlanat127 20-12-2020 18 3   Download

In our study, we used molecular dynamics simulation (MD) to study diffusion mechanism in liquid MgO at a temperature of 3800K at a pressure ranging from 0 to 25 GPa. The calculated results and analysis of dynamical properties, spatially heterogeneous dynamics and diffusion mechanisms in MgO liquids will be reported in detail in this work.

10p tamynhan8 04-11-2020 14 3   Download

In this work, we investigated the adsorption mechanism of acetone and toluene on the surface of silicene by the quantum simulation method. The images of the potential energy surfaces for different positions of the adsorbate on the silicene surface were explored by Computational DFTbased Nanoscope tool for determination of the most stable configurations and diffusion possibilities.

8p tamynhan6 14-09-2020 24 3   Download

The dynamic properties of iron liquid (Fe) are studied by molecular dynamics (MD) simulation. We trace the evolution of local density fluctuations (LDFs) in Fe liquid over the simulation time and in the 300-2300 K temperature range. The result simulation reveals that atomic diffusion is realized through the LDFs and the high localization LDFs at low temperature in the iron liquid is the cause of the anomalous dynamics slowdown. We find that the diffusion depends on both rate of LDFs and the averaged square displacement of particles Fe as one LDF occurs.

6p blackwidow123 15-06-2018 28 3   Download

Prions are infectious proteins, in which self-propagating amyloid conforma-tions of proteins are transmitted. The budding yeast Saccharomyces cerevi-siae, one of the best-studied model eukaryotes, also has prions, and thus provides a tractable model system with which to understand the mechanisms of prion phenomena.

10p mobifone23 18-01-2013 28 3   Download

Diffuse noxious inhibitory controls (DNIC) can be produced by different types of conditioning stimuli, but the analgesic properties and underlying mechanisms remain unclear. The aim of this study was to differentiate the induction of DNIC analgesia between noxious electrical and inflammatory conditioning stimuli. Methods: First, rats subjected to either a supramaximal electrical stimulation or an injection of high-dose formalin in the hind limb were identified to have pain responses with behavioral evidence and spinal Fos-immunoreactive profiles. Second, suppression of tail-flick...

13p toshiba23 18-11-2011 48 5   Download