Template Option

 

EdPCR program present the next posibilities :

 

·        Simple Calculation Template Dialog

·        Instrument Resolution File

 

 

 

Simple Calculation Template Dialog

 

 

The present dialog aims to give to users an easy form to do a fast convertion of different formats into a PCR file by importing data from already existing files generated by other programs or written by hand.

 

The user can select a type of pattern calculation (Xray, Neutron or T.O.F). Import information from different formats (ASCII, CIF, SHELX) and complete the necessary information for calculating a powder diffraction pattern using a special instrumental resolution file (see FullProf manual).

The minimal information required is: cell parameters, space group or symmetry operators, and atom positions.

 

 

 

Instrumental resolution file

 

 

 

TOF

 

Table