Computation of Warren-Cowley SRO parameters for each atom

[lichao505917586]

Can this code be used to get Warren-Cowley SRO parameters for each atom, like this diagram?

[killiansheriff]

Hi - not in the current form, though the required changes are pretty straightforward to do and could reuse a huge chunk of this code base. Happy to do it if you want to collaborate!

[lichao505917586]

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        Thank you for your reply. I read your code on the official website of ovito, and I want to add the calculation of this parameter, but I am not familiar with python language and cannot read your code. Many published papers have calculated this parameter, and I think this parameter is important. Can you add calculations to your current code if it doesn't take too long? Thanks!

    
        
    


 

    
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On 2/7/2024 22:07，Killian ***@***.***> wrote： 

Hi - not in the current form, though the required changes are pretty straightforward to do and could reuse a huge chunk of this code base. Happy to do it if you want to collaborate!

—Reply to this email directly, view it on GitHub, or unsubscribe.You are receiving this because you authored the thread.Message ID: @.***>

[nnn911]

Hi, I just noticed this issue, I think I solved it in #5 . Please let me know what you think. Cheers, Daniel

[killiansheriff]

Thanks Daniel! @lichao505917586 let us know if this solve your issue.

Best, Killian

[lichao505917586]

font{
    line-height: 1.6;
}
ul,ol{
    padding-left: 20px;
    list-style-position: inside;
}




    
        I'm sorry, I'm busy with other things at this time and I don't have the energy to try this. 

    
        
    


 

    
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On 4/4/2025 06:16，Killian ***@***.***> wrote： 

Closed #3 as completed.

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