CCL: About Dalton2011
- From: "Eli Lam" <elizabeth.shlam]-[gmail.com>
- Subject: CCL: About Dalton2011
- Date: Tue, 4 Oct 2011 06:18:30 -0400
Sent to CCL by: "Eli Lam" [elizabeth.shlam]^[gmail.com]
Dear CCLers,
I'm new to the DALTON2011 program. However, after installation and all tests
passed, when I try to submit a test job, it gives the following error
message:
> ../../bin/dalton.x energy_nosymm energy_nosymm
DALTON: default work memory size used.
Work memory size (LMWORK+2): 131000002 = 999.45 megabytes; node 0
0: Directories for basis set searches:
./:
MPI node no.: 0
Reason: ERROR (GPOPEN) TRYING TO OPEN A NON-EXISTING FILE AS OLD
Node 0: --- SEVERE ERROR, PROGRAM WILL BE ABORTED ---
ERROR (GPOPEN) TRYING TO OPEN A NON-EXISTING FILE AS OLD
STOP 100
Backtrace for this error:
+ function mpi_bcast_ (0x80BF9E5)
+ function quit_ (0x9A01347)
+ function gpopen_ (0x9A08E45)
+ function dalton_gnrlinp_ (0x80C4307)
+ in the main program
from file dalton.F
+ /lib/libc.so.6(__libc_start_main+0xf3) [0x4aa89413]
Would you please advise for any solutions? Thanks so much!
Regards,
Eli