[gmx-users] range_check ci fatal error

[David van der Spoel]

On Mon, 2003-03-10 at 12:09, Giorgos Karvounis wrote:
> Dear all,
> 
> after 107480 steps of a simulation without T/P coupling (equilibrated
> with weak coupling for 20000 steps of 2 fs before the full run) i got
> the following range_check error:
> 
> Fatal error: ci = -214748364
> 8 should be in 0 .. 139 [FILE nsgrid.c, LINE 210]
> 
> Do i have to change the range of my box or is it something more
> profound?

have you checked energies and density, temperature and pressure?

are you running on an overheated Athlon?

> Thanks in advance
> 
> Giorgos
> 
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-- 
Groeten, David.
________________________________________________________________________
Dr. David van der Spoel, 	Dept. of Cell & Mol. Biology
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://xray.bmc.uu.se/~spoel
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