SUPERFLIP– a computer program for the solution of crystal structures by charge flipping in arbitrary dimensions

• Published in: Journal of Applied Crystallography, vol. 40, num. 4, p. 786-790
• Publication date: 2007

SUPERFLIP is a computer program that can solve crystal structures from diffraction data using the recently developed charge-flipping algorithm. It can solve periodic structures, incommensurately modulated structures and quasicrystals from X-ray and neutron diffraction data. Structure solution from powder diffraction data is supported by combining the charge-flipping algorithm with a histogram-matching procedure. SUPERFLIP is written in Fortran90 and is distributed as a source code and as precompiled binaries. It has been successfully compiled and tested on a variety of operating systems.

Reference

• LCR-ARTICLE-2008-014
• doi:10.1107/S0021889807029238
• View record in Web of Science

Record created on 2008-01-10, modified on 2012-03-21