Minor modifications of ESPOIR allow new functionalities :
- working in the hypothesis of merohedral twinning.
- using molecule global scattering factors (useful for
searching a C60 molecule with orientational disorder).
The test file is the same as in Fullprof (C60 in Fm3m).
http://sdpd.univ-lemans.fr/sdpd/espoir/
Best,
Armel Le Bail - http://www.cristal.org/
P.S. About such global scattering factors, data and/or
references are welcome.
