gnxastitle

Version 12.2006

Linux

 

Version 12.2006 of GNXAS contains an upgraded FITHEO program. It incorporates all of the features of the previous 12.2001,x.99 and x.00, x.0000 versions so please refer to previous  readme pages. Compiled using g77 fortran compiler, it is presently available only for Linux platforms (compatible with 2.6.13 Kernel, SUSE 10 distribution).


Present upgrades in FITHEO:

  • Constraints for (multiple-edge) fitting of liquid binary mixtures have been introduced according to the theory exposed in A. Trapananti, A. Di Cicco, Phys. Rev. B, vol. 70, 014101 (2004). Here partial radial distribution functions are thought to be decomposed into 2 peaks + long-range tail. Information about the detailed usage of the program using this option should be asked to the authors.
  • Output of residual in runfit.par file corrected. 
  • Tested normal functions in SiCl4 molecule and AgBr crystal cases.


Comments to andrea.dicicco@unicam.it or adriano.filipponi@aquila.infn.it