Institut de Chimie Moléculaire et des Matériaux d'Orsay

Determination of crystal structures on single crystal

• SIR
• SHELXS

Refinement of crystal structures on single crystal

• SHELXL
  • SHELX Homepage
  • Wiki SHELXL
  • A short history of SHELX (Sheldrick, G.M. (2008). Acta Cryst. A64, 112-122)
• Crystals
• Jana
• MoPro

Other software

• "Processing of Bruker & Nonius CCD data" (L. Faruggia)
• Site de L. Faruggia (Glasgow): WinGX, Platon, Ortep, DIRDIF, Struplo ...
• Laugier et Bochu suite: OrientExpress, Equiv, Truecell, Checkcell, Poudrix ...
• Listes des programmes du CCP14
• DIRAX

Visualization software

• DIAMOND: Crystal and Molecular Structure Visualization (licence ISCR)
• MERCURY: Crystal Structure Visualisation and Exploration Made Easy
• POVRAY - Persistence of Vision Ray Tracing
• VESTA: Visualization for Electronic and STructural Analysis
• WebLab Viewerlite

Various crystallographic tools

• PLATON: Crystallographic toolbo [T. Spek, Utrecht]
• CRYSCALC: A crystallographic calculator e [T.R. / CDIFX-ISCR Rennes]