Quick calculation of damage for ion irradiation: implementation in Iradina and comparisons to SRIM

Component Systems ◽

Collision Approximation ◽

Good Agreement

Binary collision approximation (BCA) calculation allows for two types of damage calculation: full cascade and quick calculations. Full cascade mode describes fully the cascades while in quick calculations, only the trajectory of the ion is followed and effective formulas give an estimation of the damage resulting from each collision of the ion. We implement quick calculation of damage in the Iradina code both for elemental and multi-component solids. Good agreement is obtained with SRIM. We show that quick calculations are unphysical in multi-component systems. The choice between full cascade and quick calculations is discussed. We advise to favour full cascade over quick calculation because it is more grounded physically and applicable to all materials. Quick calculations remain a good option for pure solids in the case of actual quantitative comparisons with neutron irradiations simulations in which damage levels are estimated with the NRT (Norgett-Robinson and Torrens) formulas.

Simulating the ballistic effects of ion irradiation in the binary collision approximation: A first step toward the ion mixing framework

Journal of Nuclear Materials ◽

10.1016/j.jnucmat.2017.01.012 ◽

2017 ◽

Vol 486 ◽

pp. 26-33 ◽

Cited By ~ 9

Author(s):

G. Demange ◽

E. Antoshchenkova ◽

M. Hayoun ◽

L. Lunéville ◽

D. Simeone

Keyword(s):

Ion Irradiation ◽

Binary Collision ◽

Disordering in the Ni-Al system under low dose ion-irradiation: a computer simulation study

MRS Proceedings ◽

10.1557/proc-481-371 ◽

1997 ◽

Vol 481 ◽

Cited By ~ 3

Author(s):

A. Almazouzi ◽

M. Alurralde ◽

M. Spaczer ◽

M. Victoria

Keyword(s):

Local Structure ◽

Low Dose ◽

Ion Irradiation ◽

Liquid Droplet ◽

Binary Collision ◽

Droplet Model ◽

Computer Simulation Study ◽

Transmission Electron ◽

Collision Approximation ◽

Good Agreement

ABSTRACTStarting from the radiation damage cascades, as obtained using the binary collision approximation, we derive the spatial distribution of the energy deposited into the lattice by the primary knock-on atom (PKA). We follow the time evolution of the cascade core in two ordered intermetallics Ni3Al and NiAl, using the molecular dynamics (MD) method with the embedded potential and with the liquid droplet model (LDM) in which a simplified version of the heat equation is solved. Moreover, the MD was used to determine the evolution of the local structure and to identify the disordered zones. The LDM allows us, after a calibration with MD results, to estimate the dependence of the molten volume on the PKA energy up to 1 MeV. The results show good agreement with other published simulations and the available transmission electron microscopy (TEM) observation experiments.

Binary-collision-approximation simulation for noble gas irradiation onto plasma facing materials

Journal of Physics Conference Series ◽

10.1088/1742-6596/490/1/012169 ◽

2014 ◽

Vol 490 ◽

pp. 012169

Author(s):

Seiki Saito ◽

Hiroaki Nakamura ◽

Arimichi Takayama ◽

Atsushi M Ito

Keyword(s):

Noble Gas ◽

Binary Collision ◽

Plasma Facing Materials ◽

Computer simulation of low-energy sputtering in the binary collision approximation

Applied Physics ◽

10.1007/bf00899692 ◽

1979 ◽

Vol 18 (4) ◽

pp. 381-389 ◽

Cited By ~ 85

Author(s):

M. Hou ◽

M. T. Robinson

Keyword(s):

Computer Simulation ◽

Binary Collision ◽

Low Energy ◽

BINARY COLLISION APPROXIMATION CASCADE PROGRAM CONSTRUCTION

Radiation Effects Computer Experiments ◽

10.1016/b978-0-444-86315-7.50015-6 ◽

1983 ◽

pp. 649-702

Author(s):

J.R. BEELER

Keyword(s):

Binary Collision ◽

Program Construction ◽

Spectral Line Shapes in Gases in the Binary-Collision Approximation

Advances in Chemical Physics ◽

10.1002/9780470142523.ch5 ◽

2007 ◽

pp. 235-293 ◽

Cited By ~ 137

Author(s):

A. Ben-Reuven

Keyword(s):

Spectral Line ◽

Binary Collision ◽

Line Shapes ◽

Binary Collision Approximation

Comprehensive Nuclear Materials ◽

10.1016/b978-0-12-803581-8.11649-2 ◽

2020 ◽

pp. 595-619 ◽

Cited By ~ 1

Author(s):

Christophe J. Ortiz ◽

Laurence Luneville ◽

David Simeone

Keyword(s):

Binary Collision ◽

Phase shift of solitary wave in a one-dimensional granular chain

International Journal of Modern Physics B ◽

10.1142/s0217979219500851 ◽

2019 ◽

Vol 33 (10) ◽

pp. 1950085

Author(s):

Xian-Qing Yang ◽

Yao Yang ◽

Yang Jiao ◽

Wei Zhang

Keyword(s):

Phase Shift ◽

Solitary Wave ◽

Numerical Scheme ◽

Binary Collision ◽

One Dimensional ◽

Fifth Order ◽

The Waves ◽

Theoretical Results ◽

In this paper, both the fifth-order Runge–Kutta numerical scheme and binary collision approximation are used to study the phase shift. Both numerical and theoretical results are shown that the solitary wave after head-on collision propagates along the chain behind the reference wave in both even and odd numbers of grain chains. It is the well-known feature of the appearance of the phase shift. Those results are in agreement with the experimental results. Furthermore, it is found that the phase shift is not only related to the collision position of the waves, but also to the position where the time is measured. The value of phase shift increases nonmonotonously with increasing the velocity of the opposite propagation of the wave. Binary collision approximation is applied to analyze the phase shift, and it is found that theoretical results agree well with numerical results, especially in the case of phase shift in odd chain.