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Topics - Suresh

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1
General Questions and Answers / Model-Graphene Nanoribbon
« on: December 15, 2009, 07:34 »
Hello ATK users,

How we can model Graphene Nanoribbon with moderate k points (For SCF, transmission etc) with reasonable accuracy. what will be minimum k points I should specify to get reasonable accuracy?

Thanks in advance

2
Scripts, Tutorials and Applications / How to Import Siesta into ATK
« on: July 16, 2009, 09:21 »
Dear ATK User,

I am interested to do some calculation by interfacing siesta in ATK. But I am unable to interface siesta within ATK. How one can solve this problem? Thanks in advance.

Yours

Suresh

3
General Questions and Answers / Mesh-Cutoff
« on: December 7, 2008, 10:38 »
Dear All,

Does the Mesh-cutoff depends on the number of atoms in the Unit cell.

Thanks

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