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Item _refine.ls_hydrogen_treatment


Description

              Treatment of hydrogen atoms in the least-squares refinement.

Category

refine

Mandatory Code

no

Data Type Code

ucode

Enumeration Values

Item Value Description
refall refined all H-atom parameters
refxyz refined H-atom coordinates only
refU refined H-atom U's only
noref no refinement of H-atom parameters
constr H-atom parameters constrained
mixed some constrained, some independent
undef H-atom parameters not defined

Alias Names

Alias Name Dictionary Version
_refine_ls_hydrogen_treatment cif_core.dic 2.0.1

 

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