Author Topic: the size of electrode cell in the au-dtb-au example in the vnl  (Read 2713 times)

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Offline njuxyh

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Hi  all:

there is an example au-dtb-au in the vnl example folder,

i saw its geometry carefully,  i don not know whether the electrode cell in the x and y direction is somewhat small? because according to the current cell size, the adjacent  dtb in the y direction is only about 7 angstrom.

 

Offline Anders Blom

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It is somewhat small indeed. But it's only an example :)

Offline njuxyh

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Yes, it is just an example.
 :)