[Re:01] How to calculate magnetic anisotropy energy (MAE)?

Posted on : May 23, 2024 (Thu) 01:58:08

by Hitoshi GOMI

Hello ZIMING,

If you are looking for a way to tilt crystals, you can use the keyword "tlt”.

>Also, it is now possible to tilet the crystal axis. It is
>done by using "tlt" keyword attached after bravai type
>or "aux" ("prv"), like
>
>fcctlt 0 90 0 6.65
>
>or
>
>auxtlt -0.5 0.5 0.5 0.5 -0.5 0.5 0.5 0.5 -0.5 0 90 0 5.27
>
>In both cases crystal is tilted by Euler angle (0, 90, 0).

Hitoshi GOMI