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Unit tests break on macos-14 using gcc-14.2.0.1 #26

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marcelmbn opened this issue Nov 19, 2024 · 0 comments · May be fixed by #28
Open

Unit tests break on macos-14 using gcc-14.2.0.1 #26

marcelmbn opened this issue Nov 19, 2024 · 0 comments · May be fixed by #28
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@marcelmbn
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See the following logs:
The detailed logs are attached.

testlog.txt

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
―――――――――――――――――――――――――――――――――――――――――― ✀  ―――――――――――――――――――――――――――――――――――――――――――
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
―――――――――――――――――――――――――――――――――――――――――――――――――――――――――――――――――――――――――――――――――――――――――

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
@marcelmbn marcelmbn added the bug Something isn't working label Nov 19, 2024
@marcelmbn marcelmbn linked a pull request Nov 20, 2024 that will close this issue
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