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by Rainbow
Thu Feb 21, 2019 1:05 pm
Forum: VTSTTools
Topic: NEB calculation seems to be tremendously slow
Replies: 1
Views: 9464

NEB calculation seems to be tremendously slow

Hi, I've been trying to run some cNEBs for compression of a methylthiolate species between Cu(100) slabs. However, the calculation seems to be tremendously slow (10+ days with 6 nodes 12 cores/node). Is there anything in the INCAR here that I can change to speed up the process? SYSTEM = cNEB MeS/Cu(...