How do I calculate cascade volume in a steel alloy under ion irradiation?

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Discussion Overview

The discussion centers on calculating the cascade volume in a steel alloy subjected to ~1 MeV ion irradiation, specifically focusing on the electronic stopping regime and the energy of primary knock-on atoms (PKA). Participants explore methods for this calculation, including potential use of simulation tools and analytical approaches.

Discussion Character

  • Exploratory
  • Technical explanation
  • Debate/contested

Main Points Raised

  • One participant seeks assistance in calculating cascade volume during ion irradiation, mentioning a PKA energy of ~10 keV.
  • Another participant suggests checking existing simulation tools like Geant4 for insights.
  • A participant indicates they must calculate the volume from scratch due to limited programming skills and mentions deriving a volume of 50 nm3 using a maximum cascade temperature of ~10000 K, which they feel is small.
  • There is a mention of Averback's equation and TRIM results, with the participant expressing doubt about their applicability given the PKA energy of 14 keV leading to about 10 keV for damage energy.
  • Another participant recommends using existing software packages or references to understand the calculations better.

Areas of Agreement / Disagreement

Participants do not reach a consensus on the best approach to calculate cascade volume, with differing opinions on the utility of existing software versus analytical methods.

Contextual Notes

Participants express uncertainty regarding the adequacy of their calculations and the applicability of certain equations, indicating potential limitations in their approaches.

nukapprentice
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So I was wondering if anyone could help me out. I am trying to find a way to calculate the cascade volume in a steel alloy undergoing ~ 1 MeV ion irradiation ( Z ~ 25). For this analysis I will be looking at the electronic stopping regime with PKA energy of ~ 10 keV. Not sure what to do after calculating the PKA energy.
 
Do you have to do it from scratch, or can you check what common simulation tools like Geant4 are doing?
 
I have to do it from scratch since my programming abilities are very limited. I actually came up with a volume analytically using a maximum cascade temperature of ~10000 K, but the volume seems small ( V = 50 nm^3 ). Since I am trying to calculate the volume mid ion range, (about halfway through) I think using Averback's equation from TRIM results will not be helpful. My PKA energy is actually 14 keV which leads to approximately 10 keV for damage energy. You wouldn't happen to know of any Matlab code to handle this would you?
 
I would use some existing software package, or at least see what they did (there should be some references explaining that, I just don't know where).
 
Ok, thanks for the replies.
 

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