The sub-menu Solve is shown on the left. It allows: .
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Start Jav on the map computed using the phases related to the selected trial. If a model is avaible, it will be included in the plot. For details see the help on-line of Jav.
Start the 2D contour procedure on the map computed using the phases related to the selected trial.
Manage contouring levels. |
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Set limit & graphic resolution. |
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Show / Hide atomic model. |
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Show / Hide unit cell. |
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Magnify the plot. |
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Un-magnify the plot. |
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Let the plot fit the drawing window. |
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Project plot on the plane normal to a. |
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Project plot on the plane normal to b. |
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Project plot on the plane normal to c. |
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Plot previous section(s). |
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Plot next section(s). |
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Plot more than one section per time. |
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Show / Hide grid. |
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Credits. |
Select among the best R% trials |
The best n trials (i.e. the trials with the lowest values of the crystallographic residual) have been stored in the project file. In default n is equal to 5 for electron diffraction data, equal to 1 otherwise.
By means of this menu item the user can view and restore the model corresponding to the selected trial.
The following window allows to re-compute phases for a (previously explored) trial. It is possible to select the starting phases procedure (MDM Patterson or VLD) and to define the final steps of Direct Space Refinement (see Description of Sir2014, Phase Module).
When the solution is not satisfactory, the user can explore new trials defining the Solving Strategy, threshold on R% and number of trials to explore.
The dialog of Simulated Anneling in Sir2014 is described here.
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