[Pw_forum] New BFGS file updated and the results is coming up.

Nicola Marzari marzari at MIT.EDU
Thu Jul 3 19:18:20 CEST 2008


> 
> I'm look forwar for your advice.


Try rutile. Try Ti metal. Try an oxygen molecule. Do they all work ?

			nic


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Prof Nicola Marzari   Department of Materials Science and Engineering
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