From NWChem
Viewed 989 times, With a total of 1 Posts
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Just Got Here
Threads 2
Posts 2
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| 8:51:45 PM PST - Mon, Dec 20th 2010 |
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Dear all,
I just started to use NWChem. I tried the example for the ethanol molecule in this page http://www.nwchem-sw.org/index.php/Qmmm_preparation_basic
The system I am using is Ubuntu 10.04. But I got the error message below:
geom_rtdb_load: not found or rtdb corrupt: geometry -> geometry
geom_rtdb_load: open geometies: 1
1 geom_rtdb_load: "geometry" -> "geometry"
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- 0: pre_mkseq: geom_rtdb_load failed 0
0:0::: 0
(rank:0 hostname:kickseed pid:21346):ARMCI DASSERT fail. armci.c:ARMCI_Error():260 cond:0
Last System Error Message from Task 0:: No such file or directory
0: ARMCI aborting 0 (0).
0: ARMCI aborting 0 (0).
system error message: Illegal seek
I also tried the two getting started examples in this page http://www.nwchem-sw.org/index.php/Getting_Started. It worked well for these two examples.
Can I have your help? Thanks a lot.
Xiao Shu
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| 4:10:24 PM PST - Tue, Jan 11th 2011 |
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| Do you have etl0.pdb in your run directory? If not this will cause the problem
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