[GSAS-II] GSAS|| scriptable: How to get cell parameters and esd from sequential refinement results
Ivo Alxneit
ivo.alxneit at psi.ch
Fri May 24 03:10:14 CDT 2019
Dear all,
in GSASII scriptable I can get cell parameters and their esd values for
a phase by
for phase in phases:
phase.get_cell_and_esd()
Is there a similar function for sequential refinements where I vary
HStrain? Something that would allow me to
data = project['Sequential results']['data']
for h in data['histNames']:
data[h].get_cell_and_esd(phase_name)
Thanks for any help!
BTW: The section for scriptable has recently disappeared from
https://gsas-ii.readthedocs.io/en/latest/
gruss, ivo
--
Dr. Ivo Alxneit
Catalysis for Energy Group
Bioenergy and Catalysis Laboratory phone: +41 56 310 4092
Paul Scherrer Institute fax: +41 56 310 2688
CH-5232 Villigen gnupg key: 0x515E30C7
Switzerland
https://www.psi.ch/ceg/
-------------- next part --------------
A non-text attachment was scrubbed...
Name: signature.asc
Type: application/pgp-signature
Size: 181 bytes
Desc: OpenPGP digital signature
URL: <http://mailman.aps.anl.gov/pipermail/gsas-ii/attachments/20190524/60cb3d35/attachment.sig>
More information about the GSAS-II
mailing list