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Tutorials and Examples

LHPM-Rietica Rietveld for Win95/NT by Brett Hunter

Rietica and GSAS Data files

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If you have problems refining on data files that are in GSAS format, please take note of the following.

(Checking of course that you have defined GSAS as your file format in the Model General menu under the bottom left Read data using format option) 

From: "HUNTER, Brett" [[email protected]]
To: "'Lachlan Cranswick'" [[email protected]]
Subject: RE: Problem with Rietica refining with GSAS data files?
Date: Tue, 27 Nov 2001 14:37:36 +1100

Hi Lachlan,

   In version 1.78 I will have it so it defaults to the STD mode in GSAS, but you must still put
something at the end (else it goes to the next line a reads a data value - then you will get an
Error in datalines.).  This means you should put std or STD or anything else (such as askjdfhkjs),
so long as something is there.  For the ALT and ESD modes you must use ESD/Esd/esd or ALT/alt/Alt.

Hope that helps

Ciao

brett


+----------------------------------------------------------------------------------+
Dr Brett Hunter
Neutron Scattering Group
Building 58, ANSTO,PMB 1, Menai, 
NSW  2234, Australia
Work:      -61-2-9717-3338
Fax:       -61-2-9717-3606
email      [email protected]
Web sites: http://www.ansto.gov.au/ansto/neut/s_hun.html
           http://www.ansto.gov.au/ansto/neut/index.html
           http://www.rietica.org
           http://www.powderdiffraction.org
PGP Public key available.
+-----------------------------------------------------------------------------------+

This is NOT a legitimate STD GSAS data file as there is no STD at the end of the second line

Sample file
BANK    1       4500       450 CONST       1000.00      2.00     0.000     0.000
 1  2310 1  2288 1  2200 1  2172 1  2155 1  2150 1  2206 1  2210 1  2286 1  2181

This is a legitimate STD GSAS data file as there is a STD at the end of the second line

Sample file
BANK    1       4500       450 CONST       1000.00    2.00   0.000   0.000   STD
 1  2310 1  2288 1  2200 1  2172 1  2155 1  2150 1  2206 1  2210 1  2286 1  2181

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