[Ifeffit] Feature request - Hephaestus: Plot multiple standards at once

Godfrey, Ian i.godfrey at ucl.ac.uk
Sat Feb 21 03:29:44 CST 2015


Dear Bruce,

Following on from this, I noticed the following - I'm not sure whether it's intended behaviour or a bug: The Athena project file with the Ag standard data in has substantially more compounds than are visible in the Hephaestus UI - please see the attached screenshots. I assume they're all supposed to be accessible from the Hephaestus standards library?

(These screenshots were taken in 0.9.21 x64 (beta 3 iirc), Windows 8.1 Pro x64 )

Regards,

Ian

----
Ian Godfrey

PhD Student,
UCL/JAIST Programme

Industrial Doctorate Centre in Molecular Modelling and Materials Science,
Department of Chemistry,
University College London

and

School of Materials Science,
Japan Advanced Institute of Science and Technology

i.godfrey at ucl.ac.uk i.godfrey at jaist.ac.jp

________________________________________
From: ifeffit-bounces at millenia.cars.aps.anl.gov <ifeffit-bounces at millenia.cars.aps.anl.gov> on behalf of Godfrey, Ian <i.godfrey at ucl.ac.uk>
Sent: 19 February 2015 03:03
To: XAFS Analysis using Ifeffit
Subject: Re: [Ifeffit] Feature request - Hephaestus: Plot multiple standards at once

Hi Bruce,

Thanks for the hint - exactly what I need.

Thanks,

Ian

----
Ian Godfrey

PhD Student,
UCL/JAIST Programme

Industrial Doctorate Centre in Molecular Modelling and Materials Science,
Department of Chemistry,
University College London

and

School of Materials Science,
Japan Advanced Institute of Science and Technology

i.godfrey at ucl.ac.uk i.godfrey at jaist.ac.jp

________________________________________
From: ifeffit-bounces at millenia.cars.aps.anl.gov <ifeffit-bounces at millenia.cars.aps.anl.gov> on behalf of Bruce Ravel <bravel at bnl.gov>
Sent: 17 February 2015 14:37
To: XAFS Analysis using Ifeffit
Subject: Re: [Ifeffit] Feature request - Hephaestus: Plot multiple standards at once

On 02/16/2015 11:41 PM, Godfrey, Ian wrote:
> Dear All,
>
>
> I'm using Hephaestus' standards library to help with some XANES
> fingerprinting and it's very useful.
>
>
> I would find it quite helpful to be able to select two (or more)
> standards from the list and plot them on the same graph for comparison.

Hi Ian,

That would not be a hard thing to implement, but I am hesitant to head
down this road.  I don't want to implement a sort of "Athena lite" in
Hephaestus.

Seems like what you really want to do is display Hephaestus' standards
data in Athena.  That way you can actually plot it with your own data.

On Windows it can be found in

   C:\strawberry\perl\site\lib\Demeter\share\standards\data

On linux, from the command line, you can find the data by doing

   ls `perl -e 'use Demeter::Here; print Demeter::Here::here,
$/'`/share/standards/data

HTH,
B


--
  Bruce Ravel  ------------------------------------ bravel at bnl.gov

  National Institute of Standards and Technology
  Synchrotron Science Group at NSLS-II
  Building 535A
  Upton NY, 11973

  Homepage:    http://bruceravel.github.io/home/
  Software:    https://github.com/bruceravel
  Demeter:     http://bruceravel.github.io/demeter/
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