Entered: Wed Jan 05 2011

Operating systems: Irix; Linux; OSF1; Unix; MS Windows


Languages: Fortran; Tcl/Tk

Distribution: Free

Application fields: Chemistry


Description: Package of 60 programs oriented towards small molecule automated structure solution, refinement, visualization, preparing publication quality tables and ORTEPs, CIF reading and writing. Additional leanings towards high precision charge density work - atomic charge calculations, contour and electric field maps +powder pattern calculation and visualization. Developed at the University of Western Australia.

References: http://www.iucr.org/resources/cif/software/xtal


Last updated: 09 May 2011