Phase Information Dialog
All Phases information is controlled by this dialog except refinable parameters. You need select a phase or delete one or add a new phase. For it you can use the next buttons:
Initial
Previous
Add
Delete
Next
Last
In the next lines we present you the actual equivalence with Fullprof parameters (dark red).
Name of Phase [PHSNM]
Name of the Phase.
Calculation [JBT]
Select the type of calculation for the phase selected.
Coefficient to calculate the weight percentage of the phase [ATZ]
Coefficient to calculate the weight percentage of the phase.
·
number of
formula units per cell
·
molecular weight
·
Used to transform the site
multiplicitiesFor a stoichiometric phase
if these multiplicities are calculated by
dividing the Wyckoff multiplicity
of the site by the general multiplicity
.
Otherwise
,
where
is the occupation number.
·
Is the Brindley coefficient that
accounts for microabsorption effects. It is required for quantitative phase
analysis only. When different phases have similar absorption (in most neutron
uses), this factor is nearly 1 (in such case
).
Define the contribution of the the currect phase for the patterns defined in the present job.
Define symmetry information of the present phase.