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Ionisation Models for Nano-Scale Simulation

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 Added by Markus Kuster
 Publication date 2010
  fields Physics
and research's language is English
 Authors H. Seo




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Two theory-driven models of electron ionization cross sections, the Binary-Encounter-Bethe model and the Deutsch-Mark model, have been design and implemented; they are intended to extend the simulation capabilities of the Geant4 toolkit. The resulting values, along with the cross sections included in the EEDL data library, have been compared to an extensive set of experimental data, covering more than 50 elements over the whole periodic table.



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135 - H. Seo 2010
Two theory-driven models of electron ionization cross sections, the Binary-Encounter-Bethe model and the Deutsch-Mark model, have been design and implemented; they are intended to extend the simulation capabilities of the Geant4 toolkit. The resulting values, along with the cross sections included in the EEDL data library, have been compared to an extensive set of experimental data, covering more than 50 elements over the whole periodic table.
Numerical simulation for comminution processes inside the vial of ball mills are performed using Monte Carlo method. The internal dynamics is represented by recently developed model based on hamiltonian involving the impact and surrounding electromagnetic potentials. The paper is focused on investigating the behaviors of normalized macroscopic pressure, $P/{P_0}$, in term of system temperature and the milled powder mass. The results provide theoretical justification that high efficiency is expected at low system temperature region. It is argued that keeping the system temperature as low as possible is crucial to prevent agglomeration which is a severe obstacle for further comminution processes.
Particle induced X-ray emission (PIXE) is a physical effect that is not yet adequately modelled in Geant4. The current status as in Geant4 9.2 release is reviewed and new developments are described. The capabilities of the software prototype are illustrated in application to the shielding of the X-ray detectors of the eROSITA telescope on the upcoming Spectrum-X-Gamma space mission.
Micro/nano porous polymeric material is considered a unique industrial material due to its extremely low thermal conductivity, low density, and high surface area. Therefore, it is necessary to establish an accurate thermal conductivity prediction model suiting their applicable conditions and provide a theoretical basis for expanding of their applications. In this work, the development of the calculation model of equivalent thermal conductivity of micro/nano porous polymeric materials in recent years was summarized. Firstly, it reviews the process of establishing the overall equivalent thermal conductivity calculation model for micro/nano porous polymers. Then, the predicted calculation models of thermal conductivity are introduced according to the conductive thermal conductivity models and the radiative thermal conductivity models separately. In addition, the thermal conduction part is divided into the gaseous thermal conductivity model, solid thermal conductivity model and gas-solid coupling model. Finally, it is concluded that, compared with other porous materials, there are few studies on heat transfer of micro/nano porous polymers, especially on the special heat transfer mechanisms such as scale effects at the micro/nanoscale. In particular, the following aspects of porous polymers still need to be further studied: micro scaled thermal radiation, heat transfer characteristics of special morphologies at the nanoscale, heat transfer mechanism and impact factors of micro/nano porous polymers. Such studies would provide a more accurate prediction of thermal conductivity and a wider application in energy conversion and storage systems.
An efficient method for the calculation of ferromagnetic resonant modes of magnetic structures is presented. Finite-element discretization allows flexible geometries and location dependent material parameters. The resonant modes can be used for a semi-analytical calculation of the power spectral density of the thermal white-noise, which is relevant for many sensor applications. The proposed method is validated by comparing the noise spectrum of a nano-disk with time-domain simulations.
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