Hi there, I was calculating polarizability which was running alright. Then suddenly I face this error.
**************************
* *
* ccresponse *
* *
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forrtl: severe (174): SIGSEGV, segmentation fault occurred
Image PC Routine Line Source
libgdma.so 00007F938BB2D0DC for__signal_handl Unknown Unknown
libpthread-2.31.s 00007F9392BF73C0 Unknown Unknown Unknown
core.cpython-38-x 00007F938CB8F6CC Unknown Unknown Unknown
core.cpython-38-x 00007F938CB8DCDB Unknown Unknown Unknown
core.cpython-38-x 00007F939087297B Unknown Unknown Unknown
core.cpython-38-x 00007F939097278B Unknown Unknown Unknown
core.cpython-38-x 00007F939097297B Unknown Unknown Unknown
core.cpython-38-x 00007F93905509EF Unknown Unknown Unknown
python3.8 000055A46A0088EE Unknown Unknown Unknown
python3.8 000055A469FFD75F _PyObject_MakeTpC Unknown Unknown
python3.8 000055A46A0A6FD7 _PyEval_EvalFrame Unknown Unknown
python3.8 000055A46A098480 _PyEval_EvalCodeW Unknown Unknown
python3.8 000055A46A099A44 _PyFunction_Vecto Unknown Unknown
python3.8 000055A46A003B19 PyObject_Call Unknown Unknown
python3.8 000055A46A0A3ABE _PyEval_EvalFrame Unknown Unknown
python3.8 000055A46A098480 _PyEval_EvalCodeW Unknown Unknown
python3.8 000055A46A099A44 _PyFunction_Vecto Unknown Unknown
python3.8 000055A46A0A3159 _PyEval_EvalFrame Unknown Unknown
python3.8 000055A46A098480 _PyEval_EvalCodeW Unknown Unknown
python3.8 000055A46A099D33 PyEval_EvalCode Unknown Unknown
python3.8 000055A46A10D4A2 Unknown Unknown Unknown
python3.8 000055A46A11E292 Unknown Unknown Unknown
python3.8 000055A46A120ECA PyRun_StringFlags Unknown Unknown
python3.8 000055A46A0C3775 Unknown Unknown Unknown
python3.8 000055A46A007C4D Unknown Unknown Unknown
python3.8 000055A46A0A22CB _PyEval_EvalFrame Unknown Unknown
python3.8 000055A46A098480 _PyEval_EvalCodeW Unknown Unknown
python3.8 000055A46A099D33 PyEval_EvalCode Unknown Unknown
python3.8 000055A46A10D4A2 Unknown Unknown Unknown
python3.8 000055A46A11E292 Unknown Unknown Unknown
python3.8 000055A46A12142B Unknown Unknown Unknown
python3.8 000055A46A12160F PyRun_SimpleFileE Unknown Unknown
python3.8 000055A46A121AE9 Py_RunMain Unknown Unknown
python3.8 000055A46A121CE9 Py_BytesMain Unknown Unknown
libc-2.31.so 00007F9392A170B3 __libc_start_main Unknown Unknown
python3.8 000055A46A0C3847 Unknown Unknown Unknown
What could have gone wrong? I have adequate memory, cleared scratch.
This is my input,
memory 16GB
molecule{
0 2
C -1.309749745 1.180176173 -0.025170341
O -0.725300438 2.155147669 0.452713346
C -2.816719340 1.155998649 -0.110605975
H -3.220628949 1.262541455 0.893082386
H -3.209427538 0.248634016 -0.561900090
H -3.143158132 2.016595633 -0.688893115
units angstrom
symmetry c1
}
set{
basis def2-svp
reference uhf
DFCC False
Freeze_core True
CACHELEVEL 0
scf_type direct
print 2
}
set_num_threads(32)
properties('ccsd',properties=['polarizability'])
Please help
I am using Psi4 1.4 release Git: Rev {master} 9485035