@@ -44,15 +44,15 @@ Productively running SrMise requires, in basic, the following elements:
44442) The experimental uncertainties. In principle these should be reported with
4545 the data, but in practice experimental uncertainties are frequently not
4646 reported, or are unreliable due to details of the data reduction process.
47- In these cases the user should specify an ad hoc value. In peak extraction
48- an ad hoc uncertainty necessarily results in ad hoc model complexity, or,
47+ In these cases the user should specify an * ad hoc* value. In peak extraction
48+ an * ad hoc* uncertainty necessarily results in * ad hoc* model complexity, or,
4949 more precisely, a reasonable model complexity if the provided uncertainty
5050 is presumed correct. (Even when the uncertainties are known, specifying an
51- ad hoc value can be a pragmatic tool for exploring alternate models,
51+ * ad hoc* value can be a pragmatic tool for exploring alternate models,
5252 especially in conjunction with multimodeling analysis.) Note that for both
5353 peak extraction and peak fitting the estimated uncertainties of peak
5454 parameters (i.e. location, width, intensity) are dependent on the
55- experimental uncertainty
55+ experimental uncertainty.
56563) The PDF baseline. For crystalline samples the baseline is linear and can
5757 be readily estimated. For nanoparticles more effort is required as SrMise
5858 includes explicit support for only a few basic shapes, although the user
9595* TiO2_parameterdetail.py_
9696 Introductory script demonstrating basic use of all SrMise parameters. Of
9797 particular interest, it covers defining a crystalline baseline with
98- explicit parameters, and assigning an ad hoc uncertainty when the
98+ explicit parameters, and assigning an * ad hoc* uncertainty when the
9999 experimental uncertainties are unreliable or unreported.
100100
101101* TiO2_initialpeaks.py_
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