X-ray Absorption Spectroscopy software packages¶
The following all have some sort of web presence, not all of which are exactly up-to-date. This list is presented alphabetically by package name.
CDXAS : Classic and Dispersive X-ray Absorption Spectroscopy
CTM4XAS : multiplet calculations of core level spectral shapes from Frank de Groot
Demeter : Bruce Ravel’s collection of analysis programs (Athena, Artemis, and Hephaestus)
DL_Excurv : Later version of EXCURV98
EDA : EXAFS Data Analysis Software Package (EDA) from Alexai Kuzmin
EXAFSPAK from Graham George
FDMNES from Yves Joly
Larch : Matt Newville’s open-source library and set of applications for processing and analyzing X-ray absorption and fluorescence spectroscopy data and X-ray fluorescence and diffraction image data from synchrotron beamlines.
LASE : Logiciel d’Analyse des Spectres EXAFS
RSXAP : EXAFS Analysis Package from Corwin Booth
SixPACK : Sam’s Interface for XAS Package, a software package for x-ray absorption spectroscopy data from Sam Webb
WinXAS by Thorsten Ressler
XANADU by Masao Takahashi and Hideto Sakane
XDAP for Windows from XAFS Services International
Here is ESRF’s rather dated list of XAFS software.
The following are software packages that were on earlier versions of this list, but which do not seem to have existing web pages
Cerius2 XAFS from Accelrys Software Inc.
EXAFS123, citation: Padden KM, Krebs JF, MacBeth CE, Scarrow RC, Borovik AS. Immobilized metal complexes in porous organic hosts: Development of a material for the selective and reversible binding of nitric oxide. J. Am. Chem. Soc. (2001) 123:1072–1079.
EXCALIB, EXBACK, and EXBROOK]] from Daresbury Lab
MAX ( Multiplatform Applications for XAFS) ]]: Alain Michalowicz’s (and coll.) collection of analysis programs, DOI: 10.1088/1742-6596/190/1/012034