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Author Topic: NEB job  (Read 5991 times)

saikat403

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NEB job
« on: November 22, 2019, 08:26:05 AM »
Hello
 I was looking modules in turbomole 7.3. For NEB method I have found two module, woelfling-job and nebmjob. I can't find anything about the second one i.e. nebmjob. I have tried woelfling-job.
But how to use this nebmjob and what is the difference between them.

with regards,
saikat
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ym21d@fsu.edu

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Re: NEB job
« Reply #1 on: May 24, 2024, 08:30:43 PM »
Hello,

I am trying to use woelfling-job, but I am not sure the correct way of combining my coord files into a file called coords. Do you have any idea? If so, could you email me at ym21d@fsu.edu

Thank you,
Yael
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