I used the NEB method and made 12 images.
But the calculation hasn't been finished yet.
I think that One CPU calculate just one image.
Can many CPUs calculate each of images??
I want to know a fast way to calculate.
I used SPRING = -5
IMAGE = 12
I have a question about NEB.
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matylove
I have a question about NEB.
Last edited by matylove on Wed Apr 16, 2008 12:08 am, edited 1 time in total.
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admin
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I have a question about NEB.
yes, of course you can have several CPUs working on one image: please give an integer multiple of the number of images as the requested number of CPUs in the script you use to run your NEB job:
eg for 12 images: if you run your job on 24 CPUs, you will have 2 CPUs working on each image
eg for 12 images: if you run your job on 24 CPUs, you will have 2 CPUs working on each image
Last edited by admin on Thu Apr 24, 2008 10:14 am, edited 1 time in total.