Hi all..............
I want to work on graphene sheet using VASP, like calculating electronic properties. But somebody told me that it is computationally expensive.is it really so? what should i do?
working on graphene sheet using VASP
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Isha
working on graphene sheet using VASP
Last edited by Isha on Thu Jul 15, 2010 8:49 am, edited 1 time in total.
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forsdan
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working on graphene sheet using VASP
The computational demands depend on what you want to do with the graphene sheet (defects, adsorption, use of hybrid functionals, etc..), and are always relative to what kind of resources you have access to. Just a clean perfect graphene sheet with LDA/GGA is not computationally expensive.
Cheers,
/Dan
<span class='smallblacktext'>[ Edited Thu Jul 15 2010, 11:24AM ]</span>
Cheers,
/Dan
<span class='smallblacktext'>[ Edited Thu Jul 15 2010, 11:24AM ]</span>
Last edited by forsdan on Thu Jul 15, 2010 9:19 am, edited 1 time in total.