TOMBO Ver.2 Manual
TOMBO
TOMBO
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A.2 1 st Brillouin zone 65<br />
Fig. A.3 Add atoms<br />
Add atoms at the origin, by changing the “element” from its default and clicking “Add”.<br />
By default the co-ordinates are in fractionals, but you can change this on the “Options” tab.<br />
Note:<br />
For some common crystal model, it can be imported:<br />
File → Import... → Structures/Examples<br />
A.2 1 st Brillouin zone<br />
Step 1<br />
Modules → CASTEP → Calculation;<br />
Step 2<br />
Properties → Band structure → More...;<br />
Step 3<br />
choose "Path...";<br />
Step 4<br />
In "Brillouin Zone Path", click "Create", and choose "Display reciprocal lattice".