Dear David<br>
<div style="padding: 10px;">Actually I posted my doubt in Vol 28, Issue 38. There I detailed
more. Anyway, my system is 1 C60 molecule in 1000 ethanol molecules. As said, I need of structures that do not
remember the previous one, i.e. that are structural and statistically not correlated.<br>
For this, up to now, I have attemped to use the autocorrelation
function of the energy and the block averaging process, but I am still
uncertain about the results. <br>
An interesting option it could be the analyzis of van Hove function, but I dont kwow how calculate them.<br>
<br>
Bests<br>
eef<br>
<br>
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<br>______________________________________<br> Eudes
Eterno Fileti<br> Centro de Ciência Naturais e Humanas<br> Universidade
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