For a Lebail extraction using Fullprof - JLKH=1 is used.
Having found this out in hindsight, does anyone know what
JLKH=0 is supposed to be doing as I can't find a reference
in the manual to JLKH=0. It somehow seems to be appending
information/HKLs to the *.HKL and *.FOU as shown below.
This occurs when performing multiple cycles to gradually
improve the profile fit.
Thanks in advance,
Lachlan.
HKL file
Phase No: 1 M3O5 intergrowth
1528 0 300.00
0 0 4 2 0.000 0.000 16.8291 0.2415
0 0 4 2 0.000 0.000 16.8291 0.2415
0 0 4 2 0.000 0.000 16.8713 0.2417
0 0 4 2 0.000 0.000 16.8713 0.2417
2 0 0 2 217.616 22.706 17.9415 0.2475
2 0 0 2 114.364 11.933 17.9415 0.2475
2 0 0 2 59.994 5.463 17.9865 0.2477
2 0 0 2 29.997 2.731 17.9865 0.2477
FOU file
Phase no.: 1 M3O5 intergrowth
0 0 4 0.00 0.00
0 0 4 0.00 0.00
2 0 0 17.41 0.92
2 0 0 12.62 0.67
2 0 -1 18.23 0.70
2 0 -1 12.88 0.50
2 0 1 16.98 0.82
2 0 1 11.61 0.56
2 0 -2 2.73 0.74
Lachlan Cranswick - Melbourne, Australia _--_|\
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E-mail : lachlan@melbpc.org.au \_.--._/
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