Fix to CASTEP atom label output

Generating cells for electronic structure calculations from CIF files

Brought to you by: torbjornb

Milestone: v1.0_(example)

Status: open

Owner: nobody

Labels: None

Priority: 1

Updated: 2016-08-26

Created: 2016-08-26

Private: No

On the input side, CASTEP uses "label=<label>" not "ID=<label>" (which is confusingly used on some outputs).</label></label>

Anonymous