I met some convergence problem.
I put a CO molecular on the Rh111 top site. I find that the CO always
vibrates along the z axis. So the structure converged very slowly. But with the same INCAR, others adsorption structures (even more complex structure which can converge more quickly)
I thought the convergence process may be related to the structure.
what can I do to accelerate the convergence process.
thank you in advance.
convergence problem
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sungeng
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convergence problem
Last edited by sungeng on Thu Oct 18, 2012 1:29 pm, edited 1 time in total.
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support_vasp
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Re: convergence problem
Hi,
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