[QE-users] NEB.x: large error in first image, applying Electric field

Masum Alihosseini masumalihosseini at gmail.com
Wed May 13 12:27:48 CEST 2020


Dear QE users and developers,

I'm trying to perform NEB calculations in the presence of the electric
field (tefield). However, I've already optimized the first and last
images, applying electric field, the error of the first and last
images are very high. How can I solve this problem and get proper
results?
best regards

Masumeh Alihosseini

PhD student, University of Zanjan, Iran
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