Your literature reference is most likely publishing Ka1 values, but there
is no guarantee. In reality, a pharmaceutical compound measured on a
laboratory XRD will not have enough resolution to separate Ka1 and Ka2.
There are two main reasons for this. First, the relatively large unit
cells, low sym
It depends on how the peak position is determined, if the position is for
the Ka1, use that value, if the position used is for the whole peak
comprised of both Ka1 and Ka2 use the weighted average.
Cheers,
Ed
On Mon, Jan 7, 2019 at 3:05 PM Nelsonsd wrote:
> Dear colleagues
>
> I have a small qu