ninja: Entering directory `/Users/marcelmueller/source/gcp/_build'
ninja: no work to do.
1/23 mctc-lib / math OK 0.02s
2/23 mctc-lib / read OK 0.02s
3/23 mctc-lib / read-ctfile OK 0.02s
4/23 mctc-lib / read-gaussian OK 0.02s
5/23 mctc-lib / read-genformat OK 0.02s
6/23 mctc-lib / read-pdb OK 0.01s
7/23 mctc-lib / read-turbomole OK 0.01s
8/23 mctc-lib / read-vasp OK 0.01s
9/23 mctc-lib / read-xyz OK 0.01s
10/23 mctc-lib / symbols OK 0.01s
11/23 mctc-lib / write OK 0.02s
12/23 mctc-lib / write-ctfile OK 0.02s
13/23 mctc-lib / write-gaussian OK 0.02s
14/23 mctc-lib / write-genformat OK 0.02s
15/23 mctc-lib / write-pdb OK 0.02s
16/23 mctc-lib / write-turbomole OK 0.02s
17/23 mctc-lib / write-vasp OK 0.01s
18/23 mctc-lib / write-xyz OK 0.01s
19/23 mctc-gcp / gcp-hf-methods OK 0.01s
20/23 mctc-gcp / gcp-dft-methods FAIL 0.01s exit status 1
>>> ASAN_OPTIONS=halt_on_error=1:abort_on_error=1:print_summary=1 UBSAN_OPTIONS=halt_on_error=1:abort_on_error=1:print_summary=1:print_stacktrace=1 MSAN_OPTIONS=halt_on_error=1:abort_on_error=1:print_summary=1:print_stacktrace=1 MESON_TEST_ITERATION=1 MALLOC_PERTURB_=30 /Users/marcelmueller/source/gcp/_build/test/tester gcp-dft-methods
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stdout:
** WARNING ** -> element mg has no virtual orbitals (no contribution)!
0.15921613343019420
stderr:
# Testing: gcp-dft-methods
Starting DFT/MINIS ... (1/10)
... DFT/MINIS [FAILED]
Message: Floating point value missmatch
Starting DFT/MINIX ... (2/10)
... DFT/MINIX [PASSED]
Starting DFT/SV ... (3/10)
... DFT/SV [PASSED]
Starting DFT/def2-SV(P) ... (4/10)
... DFT/def2-SV(P) [PASSED]
Starting DFT/def2-SVP ... (5/10)
... DFT/def2-SVP [PASSED]
Starting DFT/DZP ... (6/10)
... DFT/DZP [PASSED]
Starting DFT/def-TZVP ... (7/10)
... DFT/def-TZVP [PASSED]
Starting DFT/def2-TZVP ... (8/10)
... DFT/def2-TZVP [PASSED]
Starting DFT/cc-pVDZ ... (9/10)
... DFT/cc-pVDZ [PASSED]
Starting DFT/aug-cc-pVDZ ... (10/10)
... DFT/aug-cc-pVDZ [PASSED]
1 test(s) failed!
ERROR STOP 1
Error termination. Backtrace:
#0 0x104b26d2f
#1 0x104b278d7
#2 0x104b28b1f
#3 0x1048a629f
#4 0x1048dd85f
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21/23 mctc-gcp / gcp-3c-methods OK 0.09s
22/23 mctc-gcp / gcp-pbc OK 0.11s
23/23 mctc-gcp / gcp-gradient OK 0.49s
Summary of Failures:
20/23 mctc-gcp / gcp-dft-methods FAIL 0.01s exit status 1
Ok: 22
Expected Fail: 0
Fail: 1
Unexpected Pass: 0
Skipped: 0
Timeout: 0
Full log written to /Users/marcelmueller/source/gcp/_build/meson-logs/testlog.txt
See the following logs:
The detailed logs are attached.
testlog.txt