SS-NEB DEFECTS

Vasp transition state theory tools

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rafaelbna
Posts: 3
Joined: Thu Jan 16, 2014 6:18 pm

SS-NEB DEFECTS

Post by rafaelbna »

Dear all,

I am new in this topic and I would kindly ask you if there exist any physical problem to use SS-NEB to calculate transition state of defects in solids. Indeed, I want to use this method to understand defects diffusion in materials for battery application.

best regards
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