design a suppercell containing a dislocation
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design a suppercell containing a dislocation
Hi,
I want to build a supercell containing a dislocation. I have not done this before, so my questions are:
What is the maximum number of atoms I can input in my supercell? Do we need to stop using the periodicity of the cell in VASP? How? Thanks.
I want to build a supercell containing a dislocation. I have not done this before, so my questions are:
What is the maximum number of atoms I can input in my supercell? Do we need to stop using the periodicity of the cell in VASP? How? Thanks.
Last edited by wjfriend on Fri Dec 07, 2012 7:33 pm, edited 1 time in total.
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Re: design a suppercell containing a dislocation
Hi,
We're sorry that we didn’t answer your question. This does not live up to the quality of support that we aim to provide. The team has since expanded. If we can still help with your problem, please ask again in a new post, linking to this one, and we will answer as quickly as possible.
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