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Re: Units for B

Paula Fitzgerald (paula_fitzgerald@Merck.Com)
Mon, 18 Mar 96 11:04:43 EST


Peter Keller writes:

> >    + Added unit type 8pi2_angstroms_squared B anisotropic temperature factors,
> >      and added conversion factor for this new unit type in the
> >      ITEM_UNITS_CONVERSION category.
> 
> This needs to be done for _atom_site.B_iso_or_equiv and 
> _atom_site.B_iso_or_equiv_esd as well.

This has been done.

Paula

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