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Vasp transition state theory tools

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hexiujie
Posts: 11
Joined: Tue Sep 07, 2010 7:28 am

image

Post by hexiujie »

The more images I use, the more time it will cost. Right？Generally speaking, how many images may I use in order to get the saddle point using cNEB. Many thanks！
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lgxyz
Posts: 51
Joined: Tue Sep 07, 2010 1:52 pm

Re: image

Post by lgxyz »

For CI-NEB, 3-5 images is sufficient.
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