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Core CIF Dictionary version 2.3

_atom_sites_solution_

Names

'_atom_sites_solution_primary' '_atom_sites_solution_secondary' '_atom_sites_solution_hydrogens'

Category: atom_sites

Data type: char

Permitted values:

difmap 'difference Fourier map'
vecmap 'real-space vector search'
heavy 'heavy-atom method'
direct 'structure-invariant direct methods'
geom 'inferred from neighbouring sites'
disper 'anomalous-dispersion techniques'
isomor 'isomorphous structure methods'

Definition

    	
Codes which identify the methods used to locate the initial atomic sites. The *_primary code identifies how the first atom sites were determined; the *_secondary code identifies how the remaining non-hydrogen sites were located; and the *_hydrogens code identifies how the hydrogens were located.

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