checkCIF procedure

PROC-NAME: ABSTY01 Type_1

PURPOSE: To check that _exptl_absorpt_correction_type is one of the recognised keywords.

CHECKLIST:
  • none (none applied)
  • analytical (analytical from crystal shape)
  • integration (integration from crystal shape)
  • numerical (numerical from crystal shape)
  • gaussian (Gaussian from crystal shape)
  • empirical (psi-scan of intensities)
  • psi-scan (psi-scan of intensities)
  • multi-scan (symmetry-related measurements)
  • refdelf (refined from delta-F)
  • sphere (spherical)
  • cylinder (cylindrical)
Otherwise issue ALERT A
   "Alert A The absorption correction doesn't match a standard keyword"

IF extra text has been entered issue General ALERT
   "Extra text has been found in the _exptl_absorpt_correction_type field, which should be only a single keyword. A literature citation should be included in the _exptl_absorpt_process_details field."
Use ONLY one of the specified keywords and no other text under _exptl_absorpt_correction_type. Note that psi-scans should be indicated as 'psi-scan' and not as '\f-scan'. The citation should be in parentheses in the usual citation format.

Example:
_exptl_absorpt_correction_type psi-scan
_exptl_absorpt_process_details '(North et al., 1968)'


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