/feff85exafs

Feff for EXAFS: Open Source theoretical EXAFS fitting standards

Primary LanguageFortranBSD 2-Clause "Simplified" LicenseBSD-2-Clause

feff85exafs

DOI

Feff 8.50 for EXAFS: Open Source theoretical EXAFS calculations

Based on or developed using Distribution: FEFF8.5L Copyright (c) [2013] University of Washington

  • The goals of this project are discussed on the wiki.

Compilation requires the scons software construction tool. Testing requires python's nose tool.

To set compilation flags, edit the file src/FeffBuild.py.

To compile, test, and build, do the following in the top directory

	  feff85exafs> scons
	  feff85exafs> LD_LIBRARY_PATH='wrappers/python:src/GENFMT' && nosetests --verbosity=3
	  feff85exafs> scons install

See src/README.md for details on compiling this version of Feff, including compiling against json-fortran.

For the fortran entry point to the stand-alone F_eff calculation, the C wrapper around it, or language bindings to C wrapper, see the wrappers/ directory.