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March 19-21, 2024 | ||
================= | ||
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------ | ||
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Download all slide decks and other course materials: | ||
:download:`March2024.zip <_static/March2024.zip>` | ||
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------ | ||
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X-ray absorption spectroscopy is a core technique of the DOE | ||
synchrotron user facilities and attracts diverse scientific | ||
communities. This 3-day course offered by NSLS-II experts introduced | ||
XAS data analysis to new and prospective users and provide an | ||
opportunity to perform real experiments at NSLS-II XAS beamlines. The | ||
first two days were devoted to the fundamentals of XAS analysis, data | ||
reduction and processing, and the basics of XAS experiments and | ||
instrumentation. | ||
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Participants were trained on XAS data analysis of increasing | ||
complexity. Modern XAS methods such as high-resolution spectroscopy | ||
were be introduced. On the third day, the participants participated in | ||
the experiments at XAS beamlines and analyzed the data they collected. | ||
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`Course page at NSLS-II <https://www.bnl.gov/xascourse/>`__ | ||
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This course was organized and presented by Lu Ma, Bruce Ravel, and Eli | ||
Stavitski with additional lectures by Denis Leshchev and Akhil Tayal | ||
and help from Dali Yang. We are grateful to Kerri Banaszek for | ||
logistical support. | ||
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.. _fig-groupphoto2024: | ||
.. figure:: _images/March2024_group_photo.jpg | ||
:target: _images/March2024_group_photo.jpg | ||
:width: 50% | ||
:align: center | ||
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The participants and instructors of the October 2023 XAS Workshop | ||
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Tuesday, March 19 | ||
------------------- | ||
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:Introduction to XAS: | ||
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Overview of the basic physics and chemistry of XAS | ||
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+ Presenter: `Bruce Ravel <https://www.bnl.gov/staff/bravel>`__ | ||
+ Slide deck: :download:`XAFS2024_Intro.pdf <_static/March2024/XAFS2024_Intro.pdf>` | ||
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:Data reduction and background removal: | ||
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An introduction to processing XAS data, including background | ||
subtraction and Fourier transforms | ||
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+ Presenter: `Akhil Tayal <https://www.bnl.gov/staff/atayal>`__ | ||
+ Slide deck: :download:`XAFS_Normalization_2024.pdf <_static/March2024/XAFS_Normalization_2024.pdf>` | ||
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:EXAFS analysis I: | ||
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An introductory EXAFS data analysis problem using FeS\ | ||
:sub:`2`. This is the introduction to fitting EXAFS data analysis | ||
with Feff and Artemis | ||
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+ Presenter: `Bruce Ravel <https://www.bnl.gov/staff/bravel>`__ | ||
+ |mu|\ (E) data: :download:`FeS2_RT.xmu <_static/March2024/FeS2/FeS2_RT.xmu>` | ||
+ crystal data: :download:`FeS2.inp <_static/March2024/FeS2/FeS2.inp>` | ||
(this is a file format that Artemis can inport) | ||
+ final fitting model: :download:`FeS2_final.fpj <_static/March2024/FeS2/FeS2_final.fpj>` | ||
+ discussion of FeS\ :sub:`2` final fit: :download:`fes2.pdf <_static/March2024/fes2.pdf>` | ||
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:XANES analysis: | ||
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An introduction to methods and challenges of XANES analysis. | ||
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+ Presenter: `Denis Leshchev <https://www.bnl.gov/staff/dleshchev>`__ | ||
+ Slide deck: :download:`XANES_analysis_workshop.pdf <_static/March2024/XANES_analysis_workshop.pdf>` | ||
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Wednesday, March 20 | ||
--------------------- | ||
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:Sample preparation and sample environments: | ||
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A discussion of how to plan for your XAS experiment, how to prepare | ||
your samples for measurement, and how to plan for *in situ* and | ||
*operando* experiments | ||
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+ Presenter: `Eli Stavitski <https://www.bnl.gov/staff/istavitski>`__ | ||
+ Slide deck: :download:`Sample_prep_and_sample_environemnts_2024.pdf <_static/March2024/Sample_prep_and_sample_environemnts_2024.pdf>` | ||
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:EXAFS analysis II: | ||
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The FeS\ :sub:`2` example from the previous day might seem a bit | ||
too simple. It involves analysis of a crystalline material, thus | ||
the path through the analysis obviously starts with crystal data. | ||
In these two lectures, some ideas are presented about how to | ||
perform EXAFS analysis on more complex materials. | ||
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+ Presenter: `Bruce Ravel <https://www.bnl.gov/staff/bravel>`__ | ||
+ EXAFS and non-crystalline materials: :download:`noxtal.pdf <_static/March2024/noxtal.pdf>` | ||
+ A hard EXAFS problem, Hg bound to nucleotides: :download:`hgdna.pdf <_static/March2024/hgdna.pdf>` | ||
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:High energy resolution techniques: | ||
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High energy resolution fluorescence detection (HERFD), X-ray | ||
emission spectroscopy (XES), and resonant inelastic X-ray | ||
spectroscopy (RIXS) using crystal spectrometers. | ||
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+ Presenter: `Denis Leshchev <https://www.bnl.gov/staff/dleshchev>`__ | ||
+ Slide deck: :download:`High_resolution_techniques_workshop.pdf <_static/March2024/High_resolution_techniques_workshop.pdf>` | ||
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:Combined techniques: | ||
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How to plan for and implement additional measurement techniques | ||
such as XRD and DRIFTS during your XAS experiment. | ||
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+ Presenter: `Lu Ma <https://www.bnl.gov/staff/luma>`__ | ||
+ Slide deck: :download:`LM-XAS2024-1.pdf <_static/March2024/LM-XAS2024-1.pdf>` | ||
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Thursday, March 21 | ||
-------------------- | ||
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:Experimental session: | ||
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Hands-on XAS data collection at the NSLS-II hard X-ray spectroscopy beamlines | ||
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+ `QAS <https://www.bnl.gov/nsls2/beamlines/beamline.php?r=7-BM>`__ | ||
+ `BMM <https://www.bnl.gov/nsls2/beamlines/beamline.php?r=6-BM>`__ | ||
+ `ISS <https://www.bnl.gov/nsls2/beamlines/beamline.php?r=8-ID>`__ | ||
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Data from BMM | ||
~~~~~~~~~~~~~ | ||
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During the hands-on experiment at BMM in the morning, we measured | ||
several Mn standards along with the mineral `babingtonite | ||
<https://en.wikipedia.org/wiki/Babingtonite>`__ in fluorescence at the | ||
Mn and Fe edges. | ||
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In the afternoon, we measured several Zn standards along with the | ||
mineral `petedunnite <http://webmineral.com/data/Petedunnite.shtml>`__ | ||
in fluorescence at the Zn and Fe edges. | ||
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Zip file containing these data and the full electronic log book: | ||
:download:`BMM data.zip <_static/March2024/BMM.zip>` | ||
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Links and Resources | ||
------------------- | ||
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Here is a zip file with all of the downloads linked above: | ||
:download:`March2024.zip <_static/March2024.zip>` | ||
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+ `Tutorials at XrayAbsorption.org <https://xrayabsorption.org/tutorials/>`__ | ||
+ `Bruce's XAS Education page <http://bruceravel.github.io/XAS-Education/>`__ |
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