CASTEP > CASTEP jobs > CASTEP file formats > geom, md, ts

CASTEP file formats - task-specific files

CASTEP produces additional output files only when certain tasks are selected:

These files contain trajectory information and have the following format:

         -1.82539879E+002     -1.82539879E+002                       <-- E

Values are always specified in atomic units and one of the following letter codes will be present:

See Also:

CASTEP jobs
CASTEP file formats

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