When I try a simple computation (mostly to understand how NWChem works), a strange error always occours.
0:0:nga_create_config:ga_set_data:wrong dimension specified:: 0
(rank:0 hostname:Dell pid:9801):ARMCI DASSERT fail. armci.c:ARMCI_Error():260 cond:0
Last System Error Message from Task 0:: Inappropriate ioctl for device
0: ARMCI aborting 0 (0).
0: ARMCI aborting 0 (0).
system error message: Illegal seek"
This is really strange because the input is so simple (see below)
start H_excited
title "H_excited"
charge 0
geometry units atomic
h 0 0 0
end
basis
* library 6-31G(3df,3pd)
end
dft
mult 2
end
task tddft energy
I appreciate it if anyone can tell me what is wrong with the input.
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