The CAOS suite for Windows and UNIX is a complete single crystal refinement suite using a scripts based interface similar to Crystals. Amongst is functionality is the ability to implement complex constraints/restraints as well as automatic hydrogen placement. CAOS links into the Sir97 software, and much of CAOS is being merged into Sir for structure refinement.

Obtaining and installing CAOS

• For Windows 95/98/NT:

  • Fill in the on-line form then download the ZIPPED program file from http://www.mlib.cnr.it/isc/caos/
  • [CCP14 UK Web Mirror] | [Canadian CCP14 Mirror] | [US CCP14 Mirror] | [Australian CCP14 Mirror]
    and extract it into the c:\caos directory

  • Download the ZIPPED manual file from http://www.mlib.cnr.it/isc/caos/
  • [CCP14 UK Web Mirror] | [Canadian CCP14 Mirror] | [US CCP14 Mirror] | [Australian CCP14 Mirror]
    and extract it into the c:\caos\manual directory

  • Download the ZIPPED test dataset from http://www.mlib.cnr.it/isc/caos/
  • [CCP14 UK Web Mirror] | [Canadian CCP14 Mirror] | [US CCP14 Mirror] | [Australian CCP14 Mirror]
    and extract it into the c:\caos\test directory

  • Done!

  For feedback and comments on the software, contact Ricardo Spagna (E-mail: [email protected])
  WWW: http://www.mlib.cnr.it/isc/spagna.html

Demonstrations, Tutorial run-throughs of CAOS

• Example refinement of an Inorganic Phase Using CAOS