Calculation History

This page allows users to search through previously submitted processes and displays key information such as AiiDA database references and the calculation results. The first half of the display contains a database search UI component which enables more tailored search queries, useful if the database is significantly large. By default it will simply search for all items in the database with the process key (i.e. all previously submitted workflow/calculation processes) which will include any processes submitted by the user not just those submitted through the AiiDAlab ChemShell interface.

Once a process has been selected it becomes visible in the tree view in the second half of the display. This visualiser mirrors that of the results view when the workflow was originally submitted via the main ChemShell UI. The main process displays its state and can be expanded to show a list of associated results objects for the job. Each of these objects can then be selected and will be shown in the visualiser at the bottom of the page. This will either show a dedicated visualiser for the results object or if one is not available it will show the AiiDA database reference for the object. Example for different supported visualisers are discussed in Data Node visualisation.