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Recent Commits

Remove obsolete xrootd lea...
git:b024824
Matthias Krack 2.1h ago.

QS: consolidated quantizat...
git:edaa7f1
Hans Pabst 4.0h ago.

Unify AO density history f...
git:2509026
RTChou76 8.4h ago.

Unify XC matrix constructi...
git:a3baa5e
RTChou76 13.2h ago.

Handle all AO density imag...
git:6319166
RTChou76 13.7h ago.

Remove last MPICH leak sup...
git:0761fd1
Matthias Krack 31.6h ago.

Periodic RI-RS GW for comp...
git:7b88fc6
Jan Wilhelm 32.8h ago.

cuSOLVERMp: reuse executio...
git:ca8d286
Jiacheng Xu 33.5h ago.

Docker: Workaround missing...
git:9bf6356
Ole Schütt 33.7h ago.

LIBXS: updated LIBXS, LIBX...
git:f9c1cf8
Hans Pabst 34.1h ago.

More...

Test Coverage
Discontinued Tests
Supported compilers
NameHostStatusCommitSummaryLast OK
CSCS Daint (psmp)Alps Daint (CSCS)FAILED0761fd1 (-5)correct: 6629 / 6641; wrong: 11; failed: 1; 5min47b47fb (-207)
CSCS Daint (psmp, H100)Alps Daint (CSCS)FAILED0761fd1 (-5)correct: 6656 / 6668; wrong: 11; failed: 1; 58min9ed1a31 (-215)
CSCS Eiger (ssmp)Alps Eiger (CSCS)UNKNOWNN/AError while parsing report.bc42819 (-21)
CSCS Eiger (psmp)Alps Eiger (CSCS)UNKNOWNN/AError while parsing report.bc42819 (-21)
PrecommitHZDROKb024824 (0)Found 9779, skipped 0, checked 9779, and failed 0 files. (cached)
MiscHZDROKb024824 (0)Miscellaneous tests passed
Coding conventionsHZDROKb024824 (0)Found 0 issues (196 suppressed)
Spack (psmp, conventions)HZDROKb024824 (0)Found 0 issues (195 suppressed)
Current Toolchain (pdbg)HZDROKb024824 (0)correct: 6647 / 6647; 31min
Current Toolchain (psmp)HZDRFAILEDb024824 (0)correct: 6640 / 6648; wrong: 8; 34minbc42819 (-21)
Current Toolchain (sdbg)HZDROKb024824 (0)correct: 6550 / 6550; 16min (cached)
Current Toolchain (ssmp)HZDRFAILEDb024824 (0)correct: 5181 / 5232; wrong: 9; failed: 42; 16min37370f3 (-28)
Spack (pdbg)HZDRUNKNOWNN/AError while parsing report.0761fd1 (-5)
Spack (sdbg)HZDROKb024824 (0)correct: 6544 / 6544; 13min
Ubuntu, GCC 16 (ssmp)HZDRFAILEDb024824 (0)correct: 4946 / 4955; wrong: 8; failed: 1; 13min123285f (-31)
Ubuntu, GCC 15 (ssmp)HZDRFAILEDb024824 (0)correct: 4946 / 4955; wrong: 8; failed: 1; 13min37370f3 (-28)
Ubuntu, GCC 14 (ssmp)HZDRFAILEDb024824 (0)correct: 4946 / 4955; wrong: 8; failed: 1; 15min37370f3 (-28)
Ubuntu, GCC 13 (ssmp)HZDRFAILEDb024824 (0)correct: 4946 / 4955; wrong: 8; failed: 1; 18min37370f3 (-28)
Ubuntu, GCC 12 (ssmp)HZDRFAILEDb024824 (0)correct: 4946 / 4955; wrong: 8; failed: 1; 13min37370f3 (-28)
Ubuntu, GCC 11 (ssmp)HZDRFAILEDb024824 (0)correct: 4946 / 4955; wrong: 8; failed: 1; 18min37370f3 (-28)
Ubuntu, GCC 10 (ssmp)HZDRFAILEDb024824 (0)correct: 4946 / 4955; wrong: 8; failed: 1; 13min37370f3 (-28)
Ubuntu, GCC 9 (ssmp)HZDRFAILEDb024824 (0)correct: 4946 / 4955; wrong: 8; failed: 1; 14min37370f3 (-28)
Minimal buildHZDRFAILEDb024824 (0)Compilation failed37370f3 (-28)
CoverageHZDROK0761fd1 (-5)correct: 6648 / 6648; 20min
Spack (psmp, coverage)HZDROK0761fd1 (-5)correct: 6643 / 6643; 20min
Manual generationHZDROKb024824 (0)Manual generation works fine.
Doxygen generationHZDROKb024824 (0)Doxygen generation works fine.
ASE CalculatorHZDROKb024824 (0)ASE commit a8742a7 works fine.
Spack (psmp, ASE)HZDROK0761fd1 (-5)ASE commit 00de205 works fine
Direct Python interfaceHZDROK0761fd1 (-5)Direct Python interface type checks and tests passed.
AiiDA-CP2K PluginHZDROK0761fd1 (-5)aiida-cp2k commit f66bd3c works fine.
i-PiHZDRFAILED0761fd1 (-5)Container build had non-zero exit status.bc42819 (-21)
PhonopyHZDROK0761fd1 (-5)Phonopy commit 469481e works fine.
Gromacs QM/MMHZDROK0761fd1 (-5)Gromacs commit 1210900 works fine.
Spack (psmp, GROMACS)HZDROK0761fd1 (-5)GROMACS commit 1ede011 works fine
Spack (psmp, performance OpenMP)HZDROK0761fd1 (-5)Performance test took 69 minutes.
Performance OpenMPHZDROK0761fd1 (-5)Performance test took 109 minutes.
Performance CUDA AmpereGCPOK0761fd1 (-5)Performance test took 86 minutes.
ARM64GCPOUTDATED7fc1fe1 (-44)correct: 6427 / 6431; wrong: 3; failed: 1; 45min47b47fb (-207)
macOS on Apple M1 (psmp)MacStadiumFAILED2509026 (-2)correct: 6629 / 6641; wrong: 11; failed: 1; 67min47b47fb (-207)
Spack (ssmp, CUDA A40)GCPFAILED0761fd1 (-5)correct: 6561 / 6570; wrong: 8; failed: 1; 56min37370f3 (-28)
Spack (psmp, CUDA A40)GCPFAILED0761fd1 (-5)correct: 6662 / 6670; wrong: 8; 115minbc42819 (-21)
Spack (psmp, CUDA A40, cuSOLVERMp)GCPFAILED0761fd1 (-5)correct: 6398 / 6406; wrong: 8; 77minN/A
cuSOLVERMp (4 V100, 4 MPI x 4 OMP)SAIOK0761fd1 (-5)9 cases passed; 6 cuSOLVERMp paths verified
CUDA Ampere (psmp)GCPFAILED0761fd1 (-5)correct: 6304 / 6314; wrong: 8; failed: 2; 94minN/A
HIP ROCm build (psmp)HZDROK0761fd1 (-5)Compilation works fine.
GNU + MKL (ssmp)UZHFAILEDb024824 (0)correct: 5320 / 5371; wrong: 8; failed: 43; 11minN/A
GNU + MKL (psmp)UZHFAILED0761fd1 (-5)correct: 5392 / 5443; wrong: 8; failed: 43; 24min37370f3 (-28)
Intel oneAPI (ssmp, ifx)UZHFAILED0761fd1 (-5)Compilation faileda0d6e0f (-414)
Intel oneAPI (psmp, ifx)UZHFAILED0761fd1 (-5)Compilation failed6d276e9 (-412)
Intel oneAPI (ssmp, ifort)UZHFAILED0761fd1 (-5)Compilation failed2990480 (-528)
Intel oneAPI (psmp, ifort)UZHFAILED0761fd1 (-5)Container build had non-zero exit status.55d68b5 (-523)
Spack (ssmp)HZDRFAILED0761fd1 (-5)correct: 6537 / 6545; wrong: 8; 12minbc42819 (-21)
Spack (ssmp-static)HZDRFAILED0761fd1 (-5)correct: 6356 / 6364; wrong: 8; 20minbc42819 (-21)
Spack (OpenMPI, psmp)HZDRFAILED0761fd1 (-5)correct: 6635 / 6643; wrong: 8; 37minbc42819 (-21)
Spack (OpenMPI, pdbg)HZDROK0761fd1 (-5)correct: 6642 / 6642; 39min
OpenMPI Toolchain (psmp)HZDRFAILED0761fd1 (-5)correct: 6640 / 6648; wrong: 8; 42minbc42819 (-21)
Generic Toolchain (psmp)HZDROK0761fd1 (-5)correct: 6499 / 6499; 42min
4 MPI ranks (psmp)HZDRFAILED0761fd1 (-5)correct: 6645 / 6657; wrong: 11; failed: 1; 26min6c46d74 (-631)
Spack (psmp, 4x2)HZDRFAILED0761fd1 (-5)correct: 6639 / 6652; wrong: 12; failed: 1; 41min55d68b5 (-523)
Fedora Toolchain (psmp)HZDRFAILED0761fd1 (-5)correct: 6640 / 6648; wrong: 8; 33minbc42819 (-21)
Rawhide Toolchain (pdbg)HZDRFAILED0761fd1 (-5)correct: 6647 / 6647; slow: 1; 35min37370f3 (-28)
Spack (pdbg, rawhide)HZDROK0761fd1 (-5)correct: 6642 / 6642; 15min
Spack (psmp, fedora)HZDRFAILED0761fd1 (-5)correct: 6635 / 6643; wrong: 8; 30minbc42819 (-21)
Spack (psmp, rockylinux)HZDRFAILED0761fd1 (-5)correct: 6639 / 6647; wrong: 8; 31minbc42819 (-21)
Spack (psmp, opensuse)HZDRFAILED0761fd1 (-5)correct: 6635 / 6643; wrong: 8; 32minbc42819 (-21)
Spack (psmp, GCC 16)HZDRFAILED0761fd1 (-5)correct: 6635 / 6643; wrong: 8; 31minbc42819 (-21)
Spack (psmp, GCC 15)HZDRFAILED0761fd1 (-5)correct: 6635 / 6643; wrong: 8; 31minbc42819 (-21)
Spack (psmp, GCC 14)HZDRFAILED0761fd1 (-5)correct: 6635 / 6643; wrong: 8; 23minbc42819 (-21)
Spack (psmp, GCC 13)HZDRFAILED0761fd1 (-5)correct: 6635 / 6643; wrong: 8; 21min37370f3 (-28)
Spack (psmp, GCC 12)HZDRFAILED0761fd1 (-5)Container build had non-zero exit status.37370f3 (-28)
Spack (psmp, GCC 11)HZDRFAILED0761fd1 (-5)Container build had non-zero exit status.e90df42 (-89)
Spack (psmp, GCC 10)HZDRFAILED0761fd1 (-5)correct: 6487 / 6495; wrong: 8; 20min37370f3 (-28)
Address SanitizerHZDROK0761fd1 (-5)correct: 6632 / 6632; 104min

Page last updated: 2026-11-08T01:10:28+00:00