[RMCProfile-users] As2Se3 Structure

Judy, Laura R. LJUDY at MY.APSU.EDU
Fri Oct 21 02:40:44 BST 2016

Hi all!

I am trying to play around with RMCProfile using As2Se3. I do not have an original configuration, so I am trying to use dwbuild. I gave it a number density of 0.007397 A^-3 and input As and Se for my atoms. However, after it tells me what the total number of atoms will be (5000) it hits a segmentation fault. I am not really sure what the inner workings of this program are to figure out what input values are wrong. What can I do to avoid this seg fault?


Laura Nichols
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