Yes, this way can work to check whether your script is right or not. This message is telling that you program will run slowly to get results. from my experience, it may take 6 hours to get 100 cycle from my PC (16G RAM, 4 CPU core).
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Visualization / RASPA visualization (Density Plot)
July 30, 2022, 03:44:59 PM
Hi Prof. Dubbeldam
I hope you are doing well.
when I am trying to run example of density plot in the file (RASPA/examples/Visualization/UnitCell/Density/ERI) from your official github code, I found that the simulated results is not the same as your results written from your official document in Page 171.
Could you help to solve my problem?
I am looking forward to your reply.
I hope you are doing well.
when I am trying to run example of density plot in the file (RASPA/examples/Visualization/UnitCell/Density/ERI) from your official github code, I found that the simulated results is not the same as your results written from your official document in Page 171.
Could you help to solve my problem?
I am looking forward to your reply.
Pages1