Linear Transit

Perform a linear transit calculation. You need to select one or a few coordinates (typically using Internal coordinates). For these coordinates you specify their range, and you specify a number of linear transit steps. You can do this using the Linear Transit panel.

The result of the linear transit calculation is a series of optimized geometries. You can use ADFmovie to show these. You may set up a new calculation with ADFinput starting from one of those geometries, for example to have a better starting point for a transition state search. To do this, select that geometry using ADFmovie. Next, use the 'Transfer Coordinates to ADFinput' to use that geometry in ADFinput.

You can read more about linear transit runs in the ADF Users Guide.

 

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