Modulated structures dictionary (msCIF) version 3.2.1

Category ATOM_SITE_ROT_XHARM

Name:
'ATOM_SITE_ROT_XHARM'

Parent category:
MS_GROUP

Definition:

   

      Data items in the ATOM_SITE_ROT_XHARM category record
      details about the x-harmonics used to describe the displacive 
      modulations when the atomic domain of a given atom is restricted 
      by a crenel function. In the case of rigid groups, items in this 
      category would only include the rotational part of the modulation.
      The translational part would appear in a separate list of items 
      belonging to the ATOM_SITE_DISPLACE_XHARM category.

Category is of type Loop

Category key:
_atom_site_rot_xharm.id