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Previous activities
Workshop, tutorials and events supported by the Commission on XAFS in 2011
IUCr-IXAS Workshop in Tsukuba: NEW DATES, 8 - 9 December 2011
The International Workshop on "Improving the data quality and quantity for XAFS experiments" (Q2XAFS2011), co-organized by IUCr XAFS and SR Commissions, IXAS, KEK and Japanese XAFS Society, will be held at Kobayashi Memorial Hall, KEK, Tsukuba, Japan, on December 8th and 9th, 2011.
Q2XAFS2011 will focus on protocols for XAFS measurements and the standardization of XAFS set-ups. Newly developed XAFS beamlines and future prospects will also be discussed.
The official website will provide you with up-to-date information as the workshop approaches. This website will enable you to pre-register, register, get information about final programme, accommodation and access to Photon Factory: pfwww.kek.jp/Q2XAFS2011
XAFS Tutorials for crystallographers and beginners: August 22, 2011
The purpose of the Tutorial is to give a general introduction and analytical methods for crystallographers and beginners in the field of XAFS. Lectures will cover the fundamentals of XAFS: data analysis and its principles, theory and simulation of XAFS spectra, with applications to biology, chemistry, physics and materials science. Some tutorials will provide hands-on practice of XAFS.
http://www.iucr2011madrid.es/index.php/program/workshops
XAFS-related events at IUCr2011, Madrid, August 22-30, 2011
MICROSYMPOSIA (date, title, number and organizing/supporting commissions)
- 25-Aug XAFS Studies in Biology Coupled to Crystallography, MS42*, CXAFS
- 26-Aug Spectroscopic Approaches (XAFS, NMR, …) in crystallography, MS56*, CXAFS, CSC
- 27-Aug Radiation Damage: Consequences and Uses, MS70*, CXAFS, CSR, CBM
- 28-Aug XAFS Instrumentation: Automation, Standardization and Validation of XAFS Experiments, MS77*, CXAFS, CSR
- 29 Aug X-Ray Absorption, Diffraction and Imaging in Forensic Science and Ancient Materials, MS 91, CCACH, CPD, CXAFS
- KEYNOTE LECTURE
27-Aug, XAFS Contribution to Protein Structure-Function Investigations, KN 27 - WORKSHOP* at the Madrid Congress Palace
22 Aug, from 9:00 to 18:00, XAFS Tutorials for crystallographers and beginners
Organized by the XAFS Commission in collaboration with IXAS
SSRL Workshop on XAS and RIXS Data Analysis Using CTM4XAS and CTM4RIXS : May 24, 2011
A full day lecture and hands-on analysis session on Charge Transfer Multiplet Calculations for X-Ray Absorption Spectroscopy (CTM4XAS) will be held at SLAC.
https://www-ssrl.slac.stanford.edu/conferences/workshops/xas-rixs/index.php
X-ray techniques for materials research - From laboratory sources to free electron lasers : May 9-13, 2011
Symposium is held in Nice, France within the 2011 Spring meeting of the European Materials Research Society.
IUCr 2011 XAFS Tutorial
for crystallographers and beginners, Madrid, August 22, 2011
A one-day Tutorial on XAFS titled "IUCr 2011 XAFS Tutorial for crystallographers and beginners" was held on August 22, 2011, in Madrid before the XXII International Congress and General Assembly of the International Union of Crystallography (IUCr2011, Madrid, August 22-30, 2011 http://www.iucr2011madrid.es/index.php/program/workshops). The first IUCr XAFS Tutorial was organized by Prof. K. Asakura in Tsukuba (Japan) before the main IUCr Congress in Osaka (IUCr2008).
This time, the Tutorial (workshop1 of the IUCr2011) was organized by Dr. I. Ascone, as Chair of the IUCr Commission on XAFS (France) and Prof. J. García Ruiz (Spain) in Cooperation with the IUCr 2011 Local Organizing committee, the IUCr Commission on XAFS and International X-ray Absorption Society (IXAS). Contributions and suggestions from the IXAS's Chair, Dr. H. Oyanagi, who also co-chaired the Tutorial, are gratefully acknowledged.
The main purpose of this Tutorial was to create a bridge between XAFS and Crystallographic communities, introducing beginners XAFS technique and giving particular emphasis to the local characterization of matter.
The organization of the Tutorial in the Main Congress site (Municipal Conference Center) and its connection with the main Congress' Committees helped to reach the objective. Fifty participants registered and the average presence at the Tutorial was approximately forty, mainly PhD students and Post-Doc concerned by crystallography.
The workshop was organized in two parts. The first part was dedicated to the presentation of physical principles, experimental aspects and applications in Chemistry, Physics, Material Science and Biology. A second part was devoted to practical lessons on EXAFS data analysis and theoretical simulation of the XANES spectra, with codes commonly used or under development.
The workshop started at 9:30 with a presentation of XAFS, given by Dr. Isabella Ascone (France), dedicated to beginners, in particular to PhD students who have never used XAFS technique or even synchrotron radiation. Prof. Christopher T. Chantler (Australia) summarized theoretical basis of the spectroscopy. Dr. Hiroyuki Oyanagi (Japan), presented experimental aspects, modes of measurements, details on the synchrotron radiation XAFS beamlines; advices on how to carry out the experiments were given. Three invited speakers reviewed XAFS applications to different fields: Prof. M. Fernandez Garcia (Spain) to Chemistry, Prof. J. Garcia Ruiz (Spain) to Physics and Material Science and Prof. B. Hedman (USA) to Biology.
Some tutorials provided hands-on practice of XAFS. In particular, Prof. A. Frenkel (US) explained how to analyze the EXAFS data using FEFF and Athena codes, while Dr. E. Nazarenko (SE) showed how to perform simulations of XANES using FDMNES code, with special emphasis to non-muffin tin calculations. EXCURVE code and examples of data analysis for protein samples were presented by Dr. W. Meyer-Klaucke (DE). The MXAN code for the fitting of the XANES spectra and the improved non-muffin tin approach was introduced by Dr. K. Hatada (Italy).
The Tutorial ended at 18:00, in time for the Opening Ceremony of IUCr2011.
The content of presentations, useful links and other teaching material transmitted by speakers will soon be available on this website.
Isabella Ascone and Joaquin García Ruiz
The Organizers
Programme and links to documents provided by Tutors
SESSION 1. Chair: Joaquin García Ruiz
- 9:30 - 10:00 X-ray absorption spectroscopy for beginners. - Isabella Ascone (FR)
IUCr2011 XAFS Tutorial_ Ascone.pdf - 10:00 - 10:45 XAFS Theory: XANES and EXAFS spectra. - Christopher T. Chantler (AU)
IUCr2011-XAFS Tutorial Chantler.pdf - 10:45 - 11:30 Experimental aspects: synchrotron radiation, beamlines, detectors, measurement modes geometry, sample preparation methods. - Hiroyuki Oyanagi (JP)
IUCr2011-XAFS Tutorial Oyanagi part 1.pdf
IUCr2011-XAFS Tutorial Oyanagi part 2.pdf - 11:30 - 11:45 Coffee Break
SESSION 2. Chair: Isabella Ascone
- 11:45 - 12:30 Applications of X-Ray Absorption Spectroscopy in Physics and Material Science. - Joaquin García Ruiz (ES)
IUCr2011 XAFS Tutorial J-Garcia Ruiz.ppt - 12:30 - 13:00 Applications of X-Ray Absorption spectroscopy in Chemistry. - Marcos Fernandez-García (ES)
IUCr2011-XAFS Tutorial-MFG.pdf - 13:00 - 14:15 Lunch
SESSION 3. Chair: Hiroyuki Oyanagi
- 14:15 - 15:15 FEFF and related codes. - Anatoly Frenkel (US)
IUCr2011-XAFS Tutorial frenkel.pdf
Examples: http://www.yu.edu/faculty/afrenkel/page.aspx?id=60002&ekmensel=15074e5e_522_532_60002_1 - 15:15 - 15:45 Hands-on tutorial on FDMNES and FitIt. - Elena Nazarenko (SE)
IUCr-XAFS-Tutorial_Nazarenko.pdf
Examples: download and unzip FDMNES package from http://neel.cnrs.fr/spip.php?article875 ; download and install FitIt-setup.exe from http://nano.sfedu.ru/fitit.html (Installation code: pvhyu35g5j8) - 15:45 - 16:00 Coffee Break
- 16:00 - 16:45 Applications of X-Ray Absorption Spectroscopy in Biology. - Britt Hedman (US)
- 16:45 - 17:15 EXCURVE code. - Wolfram Meyer-Klaucke (DE)
IUCr2011 XAFS Tutorial W_Meyer-Klaucke.pdf
Examples: iucr.txt, parameter.par, EXAFS_data_example.dat, exafs.spc, FT.ft - 17:15 - 17:45 XANES: MXAN and FPMS codes. - Keisuke Hatada (JP)
IUCr2011 XAFS Tutorial-Hatada.pdf
IUCr 2014 XAFS Tutorial
for crystallographers and beginners, Montreal, August 5, 2014
A one-day, free Tutorial Workshop on XAFS titled "IUCr 2014 XAFS Tutorial for crystallographers and beginners" was held on August 5, 2014, in Montreal as a satellite event for the XXIII International Congress and General Assembly of the International Union of Crystallography (IUCr2014, Montreal, August 6-14, 2014, http://www.iucr2014.org). This workshop was organized by the IUCr XAFS Commission and the International X‐ray Absorption Society.
The first IUCr XAFS Tutorial was organized by Prof. K. Asakura in Tsukuba (Japan) before the main IUCr Congress in Osaka (IUCr2008). The second was organised by Prof. I. Ascone in Madrid (Spain) before the main IUCr Congress in Madrid (IUCr2011).
The main purpose of this Tutorial was to create a bridge between XAFS and Crystallographic communities, introducing beginners to XAFS technique and its potential applications, and giving particular emphasis to the local characterization of matter. The organization of the Tutorial in the Main Congress site and its connection with the main Congress' Committees helped to reach the objective. One hundred-sixty-five participants registered to the Tutorial.
The workshop was organized in two parts. The first part was dedicated to the presentation of physical principles, experimental aspects and applications in Chemistry, Physics, Material Science and Biology. A second part was devoted to practical lessons on EXAFS data analysis and theoretical simulation of the XANES spectra, with codes commonly used or under development.
The content of presentations, useful links and other teaching material transmitted by speakers are available on this website.
The Organizers
Programme and links to documents provided by Tutors
SESSION 1. Chair: Farideh Jalilevand (Canada)
- 9:00 - 9:45, X ‐ ray absorption spectroscopy for beginners. Welcome and some advanced theory and experimental details
Christopher T. Chantler (Australia)
ChantlerIUCrMontrealXAFSXANESXERT2014b.pdf - 9:45 - 10:15, Experimental approaches to XAS, XANES and related techniques: synchrotron radiation, beamlines, detectors, measurement modes, geometry
Bruce Bunker (USA)
BunkerIntroXAFSExperiments2014IUCr.pdf - 10:15 - 10:30 Coffee Break
SESSION 2. Chair: Bruce Bunker (USA)
- 10:30 - 11:00, Physics and Materials Science
Federico Boscherini (Italy)
Boscherini-IUCr-tutorial-XAFS-matsci-nano.pdf - 11:00 – 11:20, EXAFS Spectroscopy and Its Applications in Chemical Speciation in Solution
Farideh Jalilehvand (Canada)
2014_IUCrworkshop_Jalilehvand.pdf - 11:20 – 11:40, Applications of X-Ray Absorption Spectroscopy in Biosciences
Ritimukta Sarangi (Stanford)
RitiBio_EXAFS.pdf - 11:40 – 13:20 Lunch
SESSION 3. Chair: Christopher Chantler (Australia)
- 13:20 – 14:00, MS approach to data analysis [or FEFF and related codes]
Anatoly Frenkel (US)
frenkel.pdf
Examples: http://www.yu.edu/faculty/afrenkel/page.aspx?id=60002&ekmensel=15074e5e_522_532_
60002_1 - 14:00 – 14:40, IFEFFIT / Analysis - Applications
Shelly Kelly (USA)
ShellyKellyXAS-Overview.pdf - 14:40 – 15:00, Coffee Break
- 15:00 – 15:30, Hands - on tutorial on FDMNES and FDMX.
Jay Bourke (Australia)
JDB_IUCr14-CXAFS.pdf
Examples:- downloadand unzip FDMNES package from http://neel.cnrs.fr/spip.php?article3137&lang=en
- download and install FitIt -setup.exe from http://nano.sfedu.ru/fitit.html (Installation code: pvhyu35g5j8)…
- 15:30 - 16:00, EXCURVE code
Martin Feiters (Radboud University Nijmegen, Netherlands)
MartinFeitersEXCURVEtutorial140805.pdf - 16:00 – 16:30, Hands - on tutorial of GNXAS and applications
Keisuke Hatada (Japan, Italy) - 16:30 - 17:00, XANES: MXAN and FPMS codes
Keisuke Hatada (Japan,Italy)
UCR14_FPMS_Hatada_sub.ppt.pdf