[Columbus] cigrd error bummer (fatal):rdhcid: from sifrh1, ierr=
Zhen Lu
zhl146 at gmail.com
Sun Feb 15 11:18:31 EST 2015
Hello Everyone,
I am trying to run a geometry optimization on a 16 atom system. I am
attempting to optimize a minimum on the 3rd state (S2).
When I run the optimization calculation, it fails after the first iteration
with the following error:
Error occurred in cigrd.x errno=256
*** Error occured! ***
=== runc.error ===
end of hernew
IGNORING BNDCHK
*** End of DALTON calculation ***
end of mcdrt
end of mcuft
end of mcscf
end of mcpc
end of mcpc
end of mcpc
end of cidrt
prnopt= 0
end of tran
global arrays: 1677270 ( 12.80 MB)
vdisk: 0 ( 0.00 MB)
drt: 59999994 ( 228.88 MB)
================================================================================
using 1 npartitions of size 1 .
pliste= 0
using 1 npartitions of size 1 .
pliste= 0
Main memory management:
global 1 DP per process
vdisk 0 DP per process
stack 0 DP per process
core 1048575999 DP per process
intermediate da file sorting parameters:
nbuk= 2 lendar= 32767 nipbk= 21844 nipsg=1048390200
waiting after driverwrap .... 0
Allocating 1048575999 for ci step ...
bummer (warning):inf%bufszi too small ... resetting to
30317
end of ciudg
numv1= 1274
end of cipc
end of cidrt
prnopt= 0
end of tran
allocate: status= 0
bummer (fatal):rdhcid: from sifrh1, ierr= -1
bummer
===================================
Can anyone tell me what this means? I am running the latest version of
Columbus 7 (april 2014)
Thanks,
Zhen
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