Messages

1

General Questions and Answers / Re: Question about electric field in bulk structure

« on: August 21, 2018, 12:06 »

thanks for your reply.
I have some questions for this tutorials.
1. For silicene structure, I try to optimize the structure after insert the metallic gates and make the different result(Both for 0V/nm and 4V/nm).
   What difference for the geometry with and without the spatial region.
2. If I want to add the field along the in-plane direction and optimize the structure. How can I set the calculation?
    Can I know the path of atom movement under electric field by NEB?

thank you very much.

2

General Questions and Answers / Question about electric field in bulk structure

« on: August 15, 2018, 12:46 »

Hi
              I want to add an electric field in the specific direction for a bulk(period system) and try to optimize.
        How to modify the editor? thank you very much.