Re: Problems using BAND

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Re: Problems using BAND

From: Marcel Swart <m.swart_at_email.domain.hidden>
Date: Fri, 26 Oct 2001 19:43:44 +0200

>Dear all,
>
>I am trying a periodic BAND calculation on a 64 atoms supercell of MgO. It
>aborts inmediatly (POINTS section) with a message
>
> W O R K S P A C E I N S U F F I C I E N T
> NEEDED 72959
> AVAILABLE 39360
>
>I am using a computer where I have 3 Gb of quota.

This refers to the internal memory of the machine, NOT to the
diskspace, probably.
I think this is in K, so you have only 40MB of internal memory available ?

Note, that this may be set by the MAXMEMORYUSAGE parameter in the
settings file,
and probably can be changed on input. (In ADF this can be done; I
don't know exactly
for BAND)
Received on 2001-10-26 19:53:27

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