[QE-users] Creating a 2 × 2 × 3 Surface of Crystal Structure with 10 Å Vacuum in Burai or XCrysDen
MOSES NTSIFUL
moses.ntsiful001 at stu.ucc.edu.gh
Mon Apr 8 17:26:26 CEST 2024
Dear All,
I hope this email finds you well. I am writing to request your assistance
with a specific task related to crystal structure visualization and
manipulation. I am currently working on a project that requires the
creation of a 2 × 2 × 3 surface of a crystal structure with a 10 Å vacuum
using either Burai or XCrysDen. Despite my efforts, I have not been able to
successfully complete this task.
I was wondering if I could be provided with some guidance on how to
proceed. Specifically, I would appreciate any insights you might have on:
1.
How to create a 2 × 2 × 3 surface of a crystal structure in Burai or
XCrysDen.
2.
How to ensure that the resulting surface has a 10 Å vacuum.
Thank you in advance for the assistance. I look forward to hearing from you
soon.
Best regards,
Moses Ntsiful
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