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General Questions and Answers / Transport calculation for a Triclinic crystal
« on: March 1, 2022, 19:33 »
Hi,
I am trying to calculate the transport along the plane of a triclinic 2D crystal (attaching an example structure as 'POSCAR.txt'). The C-axis is not orthogonal to A and B.
I went through this post: https://forum.quantumatk.com/index.php?topic=5001.msg21648#msg21648
which prohibits transport calculations for such systems.
Is there any other way to accomplish this task?
Thanks,
Shreeja
I am trying to calculate the transport along the plane of a triclinic 2D crystal (attaching an example structure as 'POSCAR.txt'). The C-axis is not orthogonal to A and B.
I went through this post: https://forum.quantumatk.com/index.php?topic=5001.msg21648#msg21648
which prohibits transport calculations for such systems.
Is there any other way to accomplish this task?
Thanks,
Shreeja