Hello everyone, I have tried restarting an MD calculations from previous run after it stopped due to the exceeded wall time but the calculation starts from scratch. So my question is, can MD calculations be restarted from previous runs? if not what are the internal parallelization settings in qe input file to speed up the calculation and finish within the 48 hrs wall time specified. I have attached the input file and the submission script used to submit the calculation on psc. Kind Regards.
md.slurm
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Ti2CdC_md.in
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