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VACF and vibrationa power spectrum
Posted: Tue Oct 03, 2006 7:07 pm
by jcarrasco
From a MD calculation (positions & forces at each step), is it possible to calculate the velocity autocorrelation function? And is it then possible to compute the vibrational power spectrum?
Thanks!
Re: VACF and vibrationa power spectrum
Posted: Wed Sep 11, 2024 1:29 pm
by support_vasp
Hi,
We're sorry that we didn’t answer your question. This does not live up to the quality of support that we aim to provide. The team has since expanded. If we can still help with your problem, please ask again in a new post, linking to this one, and we will answer as quickly as possible.
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VASP