Dear All, I am wondering is there any change of the way of "locate and insert rigid body"? the version 4517 is so difficult to insert a rigid body by including all the atoms and always cannot find the right orgin and orientation? Any comments on that?
Thanks, Jinlong -----原始邮件----- 发件人:"Creuziger, Adam Abel (Fed) via GSAS-II" <[email protected]> 发送时间:2020-07-07 03:43:02 (星期二) 收件人: "Toby, Brian H." <[email protected]> 抄送: "Creuziger, Adam Abel (Fed) via GSAS-II" <[email protected]> 主题: Re: [GSAS-II] Refinement Controls in GSAS Scriptable? Shortly after I sent this, I kept scrolling in the tutorials. It looks like the tutorial on sequential refinement includes some of these settings. https://gsas-ii.readthedocs.io/en/latest/GSASIIscriptable.html#sequential-refinement The project dicts and refinement-recipe seem to focus on the histogram and phase parameters, not the global ones. Apparently I need to RTFM more... On Jul 6, 2020, at 3:31 PM, Toby, Brian H. <[email protected]> wrote: Hi Adam, Not all GSAS-II controls are exposed in the GUI (I am working on a mechanism for more generic access to controls) but the initial author of gsas2scriptable did create a mechanism for setting a bunch of refinement controls: See https://gsas-ii.readthedocs.io/en/latest/GSASIIscriptable.html#project-dicts and https://gsas-ii.readthedocs.io/en/latest/GSASIIscriptable.html#refinement-recipe. Will that do what you want? Brian On Jul 6, 2020, at 1:37 PM, Creuziger, Adam Abel (Fed) via GSAS-II <[email protected]> wrote: I was wondering where the refinement controls are set in the GSAS scriptable interface? I am following the tutorial at: https://gsas-ii.readthedocs.io/en/latest/GSASIIscriptable.html#peak-fitting and dug around a bit in the ‘GSASIIscriptable.py’ file, but could not find them. Thanks! ____________________________ Dr. Adam Creuziger National Institute of Standards and Technology (NIST) Gaithersburg, MD USA 20899.8553 Office 301-975-6015 [email protected] Visiting Research Affiliate Faculty, Metallurgical and Materials Engineering. Colorado School of Mines _______________________________________________ GSAS-II mailing list [email protected] https://mailman.aps.anl.gov/mailman/listinfo/gsas-ii
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