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Need to allow vasp to send output to stdout

Open tdprice-858 opened this issue 10 months ago • 0 comments

Pynta calls Vasp as a singlepoint calculator and it overrides the electronic convergence information after each SCF loop. This could pose problems if electronic convergence fails. We will just need to redirect the output in the Vasp calculator.

tdprice-858 avatar Mar 02 '25 01:03 tdprice-858