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{2023.06}[foss/2021b] LAMMPS 23Jun2022 #360

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merged 14 commits into from
Nov 17, 2023
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laraPPr
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@laraPPr laraPPr commented Oct 10, 2023

9 out of 90 required modules missing:

  • tbb/2020.3-GCCcore-11.2.0 (tbb-2020.3-GCCcore-11.2.0.eb)
  • archspec/0.1.3-GCCcore-11.2.0 (archspec-0.1.3-GCCcore-11.2.0.eb)
  • Voro++/0.4.6-GCCcore-11.2.0 (Voro++-0.4.6-GCCcore-11.2.0.eb)
  • kim-api/2.3.0-GCCcore-11.2.0 (kim-api-2.3.0-GCCcore-11.2.0.eb)
  • xxd/8.2.4220-GCCcore-11.2.0 (xxd-8.2.4220-GCCcore-11.2.0.eb)
  • ScaFaCoS/1.0.1-foss-2021b (ScaFaCoS-1.0.1-foss-2021b.eb)
  • PLUMED/2.7.3-foss-2021b (PLUMED-2.7.3-foss-2021b.eb)
  • VTK/9.1.0-foss-2021b (VTK-9.1.0-foss-2021b.eb)
  • LAMMPS/23Jun2022-foss-2021b-kokkos (LAMMPS-23Jun2022-foss-2021b-kokkos.eb)

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eessi-bot bot commented Oct 10, 2023

Instance eessi-bot-citc-aws is configured to build:

  • arch x86_64/generic for repo eessi-2021.12
  • arch x86_64/generic for repo eessi.org-2023.06-compat
  • arch x86_64/generic for repo eessi.io-2023.06-compat
  • arch x86_64/generic for repo eessi-2023.06-software
  • arch x86_64/intel/haswell for repo eessi-2021.12
  • arch x86_64/intel/haswell for repo eessi.org-2023.06-compat
  • arch x86_64/intel/haswell for repo eessi.io-2023.06-compat
  • arch x86_64/intel/haswell for repo eessi-2023.06-software
  • arch x86_64/intel/skylake_avx512 for repo eessi-2021.12
  • arch x86_64/intel/skylake_avx512 for repo eessi.org-2023.06-compat
  • arch x86_64/intel/skylake_avx512 for repo eessi.io-2023.06-compat
  • arch x86_64/intel/skylake_avx512 for repo eessi-2023.06-software
  • arch x86_64/amd/zen2 for repo eessi-2021.12
  • arch x86_64/amd/zen2 for repo eessi.org-2023.06-compat
  • arch x86_64/amd/zen2 for repo eessi.io-2023.06-compat
  • arch x86_64/amd/zen2 for repo eessi-2023.06-software
  • arch x86_64/amd/zen3 for repo eessi-2021.12
  • arch x86_64/amd/zen3 for repo eessi.org-2023.06-compat
  • arch x86_64/amd/zen3 for repo eessi.io-2023.06-compat
  • arch x86_64/amd/zen3 for repo eessi-2023.06-software
  • arch aarch64/generic for repo eessi-2021.12
  • arch aarch64/generic for repo eessi.org-2023.06-compat
  • arch aarch64/generic for repo eessi.io-2023.06-compat
  • arch aarch64/generic for repo eessi-2023.06-software
  • arch aarch64/neoverse_n1 for repo eessi-2021.12
  • arch aarch64/neoverse_n1 for repo eessi.org-2023.06-compat
  • arch aarch64/neoverse_n1 for repo eessi.io-2023.06-compat
  • arch aarch64/neoverse_n1 for repo eessi-2023.06-software
  • arch aarch64/neoverse_v1 for repo eessi-2021.12
  • arch aarch64/neoverse_v1 for repo eessi.org-2023.06-compat
  • arch aarch64/neoverse_v1 for repo eessi.io-2023.06-compat
  • arch aarch64/neoverse_v1 for repo eessi-2023.06-software

@laraPPr
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laraPPr commented Oct 10, 2023

bot: build repo:eessi-2023.06-software arch:x86_64/generic

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eessi-bot bot commented Oct 10, 2023

Updates by the bot instance eessi-bot-citc-aws (click for details)
  • received bot command build repo:eessi-2023.06-software arch:x86_64/generic from laraPPr

    • expanded format: build repository:eessi-2023.06-software architecture:x86_64/generic
  • handling command build repository:eessi-2023.06-software architecture:x86_64/generic resulted in:

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eessi-bot bot commented Oct 10, 2023

New job on instance eessi-bot-citc-aws for architecture x86_64-generic for repository eessi-2023.06-software in job dir /mnt/shared/home/bot/eessi-bot-software-layer/jobs/2023.10/pr_360/8032

date job status comment
Oct 10 07:07:12 UTC 2023 submitted job id 8032 awaits release by job manager
Oct 10 07:07:28 UTC 2023 released job awaits launch by Slurm scheduler
Oct 10 07:11:32 UTC 2023 running job 8032 is running
Oct 10 08:28:04 UTC 2023 finished
😁 SUCCESS (click triangle for details)
Details
✅ job output file slurm-8032.out
✅ no message matching ERROR:
✅ no message matching FAILED:
✅ no message matching required modules missing:
✅ found message(s) matching No missing installations
✅ found message matching .tar.gz created!
Artefacts
eessi-2023.06-software-linux-x86_64-generic-1696926385.tar.gzsize: 219 MiB (230487892 bytes)
entries: 11377
modules under 2023.06/software/linux/x86_64/generic/modules/all
archspec/0.1.3-GCCcore-11.2.0.lua
kim-api/2.3.0-GCCcore-11.2.0.lua
LAMMPS/23Jun2022-foss-2021b-kokkos.lua
PLUMED/2.7.3-foss-2021b.lua
ScaFaCoS/1.0.1-foss-2021b.lua
tbb/2020.3-GCCcore-11.2.0.lua
Voro++/0.4.6-GCCcore-11.2.0.lua
VTK/9.1.0-foss-2021b.lua
xxd/8.2.4220-GCCcore-11.2.0.lua
software under 2023.06/software/linux/x86_64/generic/software
archspec/0.1.3-GCCcore-11.2.0
kim-api/2.3.0-GCCcore-11.2.0
LAMMPS/23Jun2022-foss-2021b-kokkos
PLUMED/2.7.3-foss-2021b
ScaFaCoS/1.0.1-foss-2021b
tbb/2020.3-GCCcore-11.2.0
Voro++/0.4.6-GCCcore-11.2.0
VTK/9.1.0-foss-2021b
xxd/8.2.4220-GCCcore-11.2.0
other under 2023.06/software/linux/x86_64/generic
.lmod/cache/spiderT.lua
.lmod/cache/spiderT.luac_5.1
.lmod/cache/timestamp

@laraPPr
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laraPPr commented Oct 10, 2023

bot: build repo:eessi-2023.06-software arch:x86_64/intel/haswell
bot: build repo:eessi-2023.06-software arch:x86_64/intel/skylake_avx512
bot: build repo:eessi-2023.06-software arch:x86_64/amd/zen2
bot: build repo:eessi-2023.06-software arch:x86_64/amd/zen3
bot: build repo:eessi-2023.06-software arch:aarch64/generic
bot: build repo:eessi-2023.06-software arch:aarch64/neoverse_n1
bot: build repo:eessi-2023.06-software arch:aarch64/neoverse_v1

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eessi-bot bot commented Oct 10, 2023

Updates by the bot instance eessi-bot-citc-aws (click for details)
  • received bot command build repo:eessi-2023.06-software arch:x86_64/intel/haswell from laraPPr

    • expanded format: build repository:eessi-2023.06-software architecture:x86_64/intel/haswell
  • received bot command build repo:eessi-2023.06-software arch:x86_64/intel/skylake_avx512 from laraPPr

    • expanded format: build repository:eessi-2023.06-software architecture:x86_64/intel/skylake_avx512
  • received bot command build repo:eessi-2023.06-software arch:x86_64/amd/zen2 from laraPPr

    • expanded format: build repository:eessi-2023.06-software architecture:x86_64/amd/zen2
  • received bot command build repo:eessi-2023.06-software arch:x86_64/amd/zen3 from laraPPr

    • expanded format: build repository:eessi-2023.06-software architecture:x86_64/amd/zen3
  • received bot command build repo:eessi-2023.06-software arch:aarch64/generic from laraPPr

    • expanded format: build repository:eessi-2023.06-software architecture:aarch64/generic
  • received bot command build repo:eessi-2023.06-software arch:aarch64/neoverse_n1 from laraPPr

    • expanded format: build repository:eessi-2023.06-software architecture:aarch64/neoverse_n1
  • received bot command build repo:eessi-2023.06-software arch:aarch64/neoverse_v1 from laraPPr

    • expanded format: build repository:eessi-2023.06-software architecture:aarch64/neoverse_v1
  • handling command build repository:eessi-2023.06-software architecture:x86_64/intel/haswell resulted in:

  • handling command build repository:eessi-2023.06-software architecture:x86_64/intel/skylake_avx512 resulted in:

  • handling command build repository:eessi-2023.06-software architecture:x86_64/amd/zen2 resulted in:

  • handling command build repository:eessi-2023.06-software architecture:x86_64/amd/zen3 resulted in:

  • handling command build repository:eessi-2023.06-software architecture:aarch64/generic resulted in:

  • handling command build repository:eessi-2023.06-software architecture:aarch64/neoverse_n1 resulted in:

  • handling command build repository:eessi-2023.06-software architecture:aarch64/neoverse_v1 resulted in:

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eessi-bot bot commented Oct 10, 2023

New job on instance eessi-bot-citc-aws for architecture x86_64-intel-haswell for repository eessi-2023.06-software in job dir /mnt/shared/home/bot/eessi-bot-software-layer/jobs/2023.10/pr_360/8033

date job status comment
Oct 10 08:35:23 UTC 2023 submitted job id 8033 awaits release by job manager
Oct 10 08:36:21 UTC 2023 released job awaits launch by Slurm scheduler
Oct 10 08:37:26 UTC 2023 running job 8033 is running
Oct 10 09:48:35 UTC 2023 finished
😁 SUCCESS (click triangle for details)
Details
✅ job output file slurm-8033.out
✅ no message matching ERROR:
✅ no message matching FAILED:
✅ no message matching required modules missing:
✅ found message(s) matching No missing installations
✅ found message matching .tar.gz created!
Artefacts
eessi-2023.06-software-linux-x86_64-intel-haswell-1696931236.tar.gzsize: 221 MiB (232522795 bytes)
entries: 11377
modules under 2023.06/software/linux/x86_64/intel/haswell/modules/all
archspec/0.1.3-GCCcore-11.2.0.lua
kim-api/2.3.0-GCCcore-11.2.0.lua
LAMMPS/23Jun2022-foss-2021b-kokkos.lua
PLUMED/2.7.3-foss-2021b.lua
ScaFaCoS/1.0.1-foss-2021b.lua
tbb/2020.3-GCCcore-11.2.0.lua
Voro++/0.4.6-GCCcore-11.2.0.lua
VTK/9.1.0-foss-2021b.lua
xxd/8.2.4220-GCCcore-11.2.0.lua
software under 2023.06/software/linux/x86_64/intel/haswell/software
archspec/0.1.3-GCCcore-11.2.0
kim-api/2.3.0-GCCcore-11.2.0
LAMMPS/23Jun2022-foss-2021b-kokkos
PLUMED/2.7.3-foss-2021b
ScaFaCoS/1.0.1-foss-2021b
tbb/2020.3-GCCcore-11.2.0
Voro++/0.4.6-GCCcore-11.2.0
VTK/9.1.0-foss-2021b
xxd/8.2.4220-GCCcore-11.2.0
other under 2023.06/software/linux/x86_64/intel/haswell
.lmod/cache/spiderT.lua
.lmod/cache/spiderT.luac_5.1
.lmod/cache/timestamp

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eessi-bot bot commented Oct 10, 2023

New job on instance eessi-bot-citc-aws for architecture x86_64-intel-skylake_avx512 for repository eessi-2023.06-software in job dir /mnt/shared/home/bot/eessi-bot-software-layer/jobs/2023.10/pr_360/8034

date job status comment
Oct 10 08:35:31 UTC 2023 submitted job id 8034 awaits release by job manager
Oct 10 08:36:18 UTC 2023 released job awaits launch by Slurm scheduler
Oct 10 08:39:38 UTC 2023 running job 8034 is running
Oct 10 09:36:12 UTC 2023 finished
😁 SUCCESS (click triangle for details)
Details
✅ job output file slurm-8034.out
✅ no message matching ERROR:
✅ no message matching FAILED:
✅ no message matching required modules missing:
✅ found message(s) matching No missing installations
✅ found message matching .tar.gz created!
Artefacts
eessi-2023.06-software-linux-x86_64-intel-skylake_avx512-1696930487.tar.gzsize: 221 MiB (232282666 bytes)
entries: 11377
modules under 2023.06/software/linux/x86_64/intel/skylake_avx512/modules/all
archspec/0.1.3-GCCcore-11.2.0.lua
kim-api/2.3.0-GCCcore-11.2.0.lua
LAMMPS/23Jun2022-foss-2021b-kokkos.lua
PLUMED/2.7.3-foss-2021b.lua
ScaFaCoS/1.0.1-foss-2021b.lua
tbb/2020.3-GCCcore-11.2.0.lua
Voro++/0.4.6-GCCcore-11.2.0.lua
VTK/9.1.0-foss-2021b.lua
xxd/8.2.4220-GCCcore-11.2.0.lua
software under 2023.06/software/linux/x86_64/intel/skylake_avx512/software
archspec/0.1.3-GCCcore-11.2.0
kim-api/2.3.0-GCCcore-11.2.0
LAMMPS/23Jun2022-foss-2021b-kokkos
PLUMED/2.7.3-foss-2021b
ScaFaCoS/1.0.1-foss-2021b
tbb/2020.3-GCCcore-11.2.0
Voro++/0.4.6-GCCcore-11.2.0
VTK/9.1.0-foss-2021b
xxd/8.2.4220-GCCcore-11.2.0
other under 2023.06/software/linux/x86_64/intel/skylake_avx512
.lmod/cache/spiderT.lua
.lmod/cache/spiderT.luac_5.1
.lmod/cache/timestamp

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eessi-bot bot commented Oct 10, 2023

New job on instance eessi-bot-citc-aws for architecture x86_64-amd-zen2 for repository eessi-2023.06-software in job dir /mnt/shared/home/bot/eessi-bot-software-layer/jobs/2023.10/pr_360/8035

date job status comment
Oct 10 08:35:38 UTC 2023 submitted job id 8035 awaits release by job manager
Oct 10 08:36:16 UTC 2023 released job awaits launch by Slurm scheduler
Oct 10 08:39:36 UTC 2023 running job 8035 is running
Oct 10 09:42:27 UTC 2023 finished
😁 SUCCESS (click triangle for details)
Details
✅ job output file slurm-8035.out
✅ no message matching ERROR:
✅ no message matching FAILED:
✅ no message matching required modules missing:
✅ found message(s) matching No missing installations
✅ found message matching .tar.gz created!
Artefacts
eessi-2023.06-software-linux-x86_64-amd-zen2-1696930847.tar.gzsize: 220 MiB (230966979 bytes)
entries: 11377
modules under 2023.06/software/linux/x86_64/amd/zen2/modules/all
archspec/0.1.3-GCCcore-11.2.0.lua
kim-api/2.3.0-GCCcore-11.2.0.lua
LAMMPS/23Jun2022-foss-2021b-kokkos.lua
PLUMED/2.7.3-foss-2021b.lua
ScaFaCoS/1.0.1-foss-2021b.lua
tbb/2020.3-GCCcore-11.2.0.lua
Voro++/0.4.6-GCCcore-11.2.0.lua
VTK/9.1.0-foss-2021b.lua
xxd/8.2.4220-GCCcore-11.2.0.lua
software under 2023.06/software/linux/x86_64/amd/zen2/software
archspec/0.1.3-GCCcore-11.2.0
kim-api/2.3.0-GCCcore-11.2.0
LAMMPS/23Jun2022-foss-2021b-kokkos
PLUMED/2.7.3-foss-2021b
ScaFaCoS/1.0.1-foss-2021b
tbb/2020.3-GCCcore-11.2.0
Voro++/0.4.6-GCCcore-11.2.0
VTK/9.1.0-foss-2021b
xxd/8.2.4220-GCCcore-11.2.0
other under 2023.06/software/linux/x86_64/amd/zen2
.lmod/cache/spiderT.lua
.lmod/cache/spiderT.luac_5.1
.lmod/cache/timestamp

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eessi-bot bot commented Oct 10, 2023

New job on instance eessi-bot-citc-aws for architecture x86_64-amd-zen3 for repository eessi-2023.06-software in job dir /mnt/shared/home/bot/eessi-bot-software-layer/jobs/2023.10/pr_360/8036

date job status comment
Oct 10 08:35:45 UTC 2023 submitted job id 8036 awaits release by job manager
Oct 10 08:36:13 UTC 2023 released job awaits launch by Slurm scheduler
Oct 10 08:39:34 UTC 2023 running job 8036 is running
Oct 10 09:31:57 UTC 2023 finished
😁 SUCCESS (click triangle for details)
Details
✅ job output file slurm-8036.out
✅ no message matching ERROR:
✅ no message matching FAILED:
✅ no message matching required modules missing:
✅ found message(s) matching No missing installations
✅ found message matching .tar.gz created!
Artefacts
eessi-2023.06-software-linux-x86_64-amd-zen3-1696930212.tar.gzsize: 220 MiB (231064640 bytes)
entries: 11377
modules under 2023.06/software/linux/x86_64/amd/zen3/modules/all
archspec/0.1.3-GCCcore-11.2.0.lua
kim-api/2.3.0-GCCcore-11.2.0.lua
LAMMPS/23Jun2022-foss-2021b-kokkos.lua
PLUMED/2.7.3-foss-2021b.lua
ScaFaCoS/1.0.1-foss-2021b.lua
tbb/2020.3-GCCcore-11.2.0.lua
Voro++/0.4.6-GCCcore-11.2.0.lua
VTK/9.1.0-foss-2021b.lua
xxd/8.2.4220-GCCcore-11.2.0.lua
software under 2023.06/software/linux/x86_64/amd/zen3/software
archspec/0.1.3-GCCcore-11.2.0
kim-api/2.3.0-GCCcore-11.2.0
LAMMPS/23Jun2022-foss-2021b-kokkos
PLUMED/2.7.3-foss-2021b
ScaFaCoS/1.0.1-foss-2021b
tbb/2020.3-GCCcore-11.2.0
Voro++/0.4.6-GCCcore-11.2.0
VTK/9.1.0-foss-2021b
xxd/8.2.4220-GCCcore-11.2.0
other under 2023.06/software/linux/x86_64/amd/zen3
.lmod/cache/spiderT.lua
.lmod/cache/spiderT.luac_5.1
.lmod/cache/timestamp

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eessi-bot bot commented Oct 10, 2023

New job on instance eessi-bot-citc-aws for architecture aarch64-generic for repository eessi-2023.06-software in job dir /mnt/shared/home/bot/eessi-bot-software-layer/jobs/2023.10/pr_360/8037

date job status comment
Oct 10 08:35:53 UTC 2023 submitted job id 8037 awaits release by job manager
Oct 10 08:36:11 UTC 2023 released job awaits launch by Slurm scheduler
Oct 10 08:39:32 UTC 2023 running job 8037 is running
Oct 10 08:48:45 UTC 2023 finished
😢 FAILURE (click triangle for details)
Details
✅ job output file slurm-8037.out
❌ found message matching ERROR:
✅ no message matching FAILED:
❌ found message matching required modules missing:
❌ no message matching No missing installations
✅ found message matching .tar.gz created!
Artefacts
eessi-2023.06-software-linux-aarch64-generic-1696927688.tar.gzsize: 0 MiB (326350 bytes)
entries: 90
modules under 2023.06/software/linux/aarch64/generic/modules/all
archspec/0.1.3-GCCcore-11.2.0.lua
software under 2023.06/software/linux/aarch64/generic/software
archspec/0.1.3-GCCcore-11.2.0
other under 2023.06/software/linux/aarch64/generic
.lmod/cache/spiderT.lua
.lmod/cache/spiderT.luac_5.1
.lmod/cache/timestamp

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eessi-bot bot commented Oct 10, 2023

New job on instance eessi-bot-citc-aws for architecture aarch64-neoverse_n1 for repository eessi-2023.06-software in job dir /mnt/shared/home/bot/eessi-bot-software-layer/jobs/2023.10/pr_360/8038

date job status comment
Oct 10 08:36:00 UTC 2023 submitted job id 8038 awaits release by job manager
Oct 10 08:36:09 UTC 2023 released job awaits launch by Slurm scheduler
Oct 10 08:39:29 UTC 2023 running job 8038 is running
Oct 10 08:48:42 UTC 2023 finished
😢 FAILURE (click triangle for details)
Details
✅ job output file slurm-8038.out
❌ found message matching ERROR:
✅ no message matching FAILED:
❌ found message matching required modules missing:
❌ no message matching No missing installations
✅ found message matching .tar.gz created!
Artefacts
eessi-2023.06-software-linux-aarch64-neoverse_n1-1696927668.tar.gzsize: 0 MiB (326834 bytes)
entries: 90
modules under 2023.06/software/linux/aarch64/neoverse_n1/modules/all
archspec/0.1.3-GCCcore-11.2.0.lua
software under 2023.06/software/linux/aarch64/neoverse_n1/software
archspec/0.1.3-GCCcore-11.2.0
other under 2023.06/software/linux/aarch64/neoverse_n1
.lmod/cache/spiderT.lua
.lmod/cache/spiderT.luac_5.1
.lmod/cache/timestamp

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eessi-bot bot commented Oct 10, 2023

New job on instance eessi-bot-citc-aws for architecture aarch64-neoverse_v1 for repository eessi-2023.06-software in job dir /mnt/shared/home/bot/eessi-bot-software-layer/jobs/2023.10/pr_360/8039

date job status comment
Oct 10 08:36:07 UTC 2023 submitted job id 8039 awaits release by job manager
Oct 10 08:37:23 UTC 2023 released job awaits launch by Slurm scheduler
Oct 10 08:39:42 UTC 2023 running job 8039 is running
Oct 10 08:48:47 UTC 2023 finished
😢 FAILURE (click triangle for details)
Details
✅ job output file slurm-8039.out
❌ found message matching ERROR:
✅ no message matching FAILED:
❌ found message matching required modules missing:
❌ no message matching No missing installations
✅ found message matching .tar.gz created!
Artefacts
eessi-2023.06-software-linux-aarch64-neoverse_v1-1696927648.tar.gzsize: 0 MiB (326077 bytes)
entries: 90
modules under 2023.06/software/linux/aarch64/neoverse_v1/modules/all
archspec/0.1.3-GCCcore-11.2.0.lua
software under 2023.06/software/linux/aarch64/neoverse_v1/software
archspec/0.1.3-GCCcore-11.2.0
other under 2023.06/software/linux/aarch64/neoverse_v1
.lmod/cache/spiderT.lua
.lmod/cache/spiderT.luac_5.1
.lmod/cache/timestamp

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laraPPr commented Oct 10, 2023

== 2023-10-10 08:47:08,014 systemtools.py:356 DEBUG Determined CPU architecture: AArch64

== 2023-10-10 08:47:08,081 build_log.py:171 ERROR EasyBuild crashed with an error (at easybuild/tools/build_log.py:111 in caller_info): Failed to determine system architecture based on aarch64-unknown-linux (at easybuild/easyblocks/t/tbb.py:101 in __init__)

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ocaisa commented Oct 10, 2023

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ocaisa commented Oct 10, 2023

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ocaisa commented Oct 10, 2023

So you could just remove the dep in a hook (or make it an arch specific dep in EasyBuild...I think you can do that)

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boegel commented Oct 10, 2023

We can add the tbb dependency conditionally in the easyconfig with a construct like:

if ARCH == 'x86_64':
    dependencies += [('tbb', '...')]

Always blindly included tbb as a dependency is a bug if it's only supported in Intel/AMD

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laraPPr commented Oct 12, 2023

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bot: build repo:eessi-2023.06-software

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New job on instance eessi-bot-mc-aws for architecture x86_64-generic for repository eessi-hpc.org-2023.06-software in job dir /project/def-users/SHARED/jobs/2023.10/pr_360/47

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Oct 13 12:12:36 UTC 2023 released job awaits launch by Slurm scheduler
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eessi-2023.06-software-linux-x86_64-generic-1697203430.tar.gzsize: 219 MiB (230503148 bytes)
entries: 11377
modules under 2023.06/software/linux/x86_64/generic/modules/all
archspec/0.1.3-GCCcore-11.2.0.lua
kim-api/2.3.0-GCCcore-11.2.0.lua
LAMMPS/23Jun2022-foss-2021b-kokkos.lua
PLUMED/2.7.3-foss-2021b.lua
ScaFaCoS/1.0.1-foss-2021b.lua
tbb/2020.3-GCCcore-11.2.0.lua
Voro++/0.4.6-GCCcore-11.2.0.lua
VTK/9.1.0-foss-2021b.lua
xxd/8.2.4220-GCCcore-11.2.0.lua
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kim-api/2.3.0-GCCcore-11.2.0
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PLUMED/2.7.3-foss-2021b
ScaFaCoS/1.0.1-foss-2021b
tbb/2020.3-GCCcore-11.2.0
Voro++/0.4.6-GCCcore-11.2.0
VTK/9.1.0-foss-2021b
xxd/8.2.4220-GCCcore-11.2.0
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entries: 11377
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archspec/0.1.3-GCCcore-11.2.0.lua
kim-api/2.3.0-GCCcore-11.2.0.lua
LAMMPS/23Jun2022-foss-2021b-kokkos.lua
PLUMED/2.7.3-foss-2021b.lua
ScaFaCoS/1.0.1-foss-2021b.lua
tbb/2020.3-GCCcore-11.2.0.lua
Voro++/0.4.6-GCCcore-11.2.0.lua
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xxd/8.2.4220-GCCcore-11.2.0.lua
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archspec/0.1.3-GCCcore-11.2.0
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PLUMED/2.7.3-foss-2021b
ScaFaCoS/1.0.1-foss-2021b
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Voro++/0.4.6-GCCcore-11.2.0
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laraPPr commented Nov 15, 2023

== 2023-11-15 11:51:34,153 build_log.py:171 ERROR EasyBuild crashed with an error (at easybuild/tools/build_log.py:111 in caller_info): Sanity check failed: sanity check command cd /tmp/eb-1slalewl/eb-bghy0lr5/eb-bl41hw6g/eb-o20j5lci/eb-g1mavv4r/tmp7463qrog && LD_LIBRARY_PATH=$LIBRARY_PATH:$LD_LIBRARY_PATH mpirun -n 1 python -c 'from lammps import lammps; l=lammps(); l.file("/cvmfs/pilot.eessi-hpc.org/versions/2023.06/software/linux/aarch64/neoverse_n1/software/LAMMPS/23Jun2022-foss-2021b-kokkos/examples/balance/in.balance")' exited with code 1 (output: LAMMPS (23 Jun 2022 - Update 1)

OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)

  using 1 OpenMP thread(s) per MPI task

Lattice spacing in x,y,z = 1.1655347 2.0187654 1.1655347

Created orthogonal box = (0 0 -0.58276737) to (58.276737 40.375308 0.58276737)

  1 by 1 by 1 MPI processor grid

Created 361 atoms 
using lattice units in orthogonal box = (0 0 -0.58276737) to (58.276737 40.375308 0.58276737)

  create_atoms CPU = 0.000 seconds

Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule

Neighbor list info ...

  update every 1 steps, delay 0 steps, check yes

  max neighbors/atom: 2000, page size: 100000

  master list distance cutoff = 2.8
ghost atom cutoff = 2.8

  binsize = 1.4, bins = 42 29 1

  1 neighbor lists, perpetual/occasional/extra = 1 0 0

  (1) pair lj/cut, perpetual

      attributes: half, newton on

      pair build: half/bin/atomonly/newton

      stencil: half/bin/2d

      bin: standard

Setting up Verlet run ...

  Unit style    : lj

  Current step  : 0

  Time step     : 0.005

Per MPI rank memory allocation (min/avg/max) = 3.05 | 3.05 | 3.05 Mbytes

   Step          Temp          E_pair         Press         f_10[3]          f_10

         0   25.701528     -29.143179     -1.2407285      1              1       

       100   26.241329     -29.685442      7.9973853      1              1   
200   26.364973     -29.8069        1.5374943      1              1       

       300   26.536041     -29.977442      2.3266255      1              1       

       400   26.593239     -30.036285      6.4409409      1              1       

       500   25.758931     -29.202281      0.63169899     1              1       

       600   26.182956     -29.628413      8.2759341      1              1       

       700   26.178016     -29.617146      1.3408724      1              1       

       800   25.785927     -29.329047      4.7746975      1              1       

       900   23.330114     -26.975455      9.5249917      1              1       

      1000   22.158525     -25.451411      1.5929558      1              1
1100   18.985702     -22.714519      7.3835594      1              1       

      1200   17.725492     -20.892696      7.5969141      1              1       

      1300   16.245349     -19.313122      3.4962639      1              1       

      1400   14.930062     -17.738077      2.145749       1              1       

      1500   14.206046     -16.894522      1.4407225      1              1       

      1600   13.429679     -16.126605      1.7866709      1              1       

      1700   12.711356     -15.467661      1.9910061      1              1       

      1800   12.64557      -15.296593      1.4555028      1              1       

      1900   12.595088     -15.216661      1.476061       1              1       

      2000   12.399899     -15.092306      1.8667394      1              1
2100   12.223764     -14.854026      1.1779008      1              1       

      2200   11.85576      -14.494318      1.2801577      1              1       

      2300   11.900876     -14.531973      1.9807282      1              1       

      2400   12.322899     -14.729887      1.3581954      1              1       

      2500   12.075932     -14.527619      1.382523       1              1       

      2600   11.839926     -14.235663      1.8295265      1              1       

      2700   11.546567     -13.959425      1.532536       1              1       

      2800   11.790032     -13.96041       1.3397406      1              1       

      2900   11.323995     -13.443242      1.6028966      1              1       

      3000   11.394544     -13.44245       1.5137429      1              1       

ERROR: Lost atoms: original 361 current 360 (src/thermo.cpp:481)
Last command: run               10000

--------------------------------------------------------------------------

Primary job  terminated normally, but 1 process returned

a non-zero exit code. Per user-direction, the job has been aborted.

--------------------------------------------------------------------------

--------------------------------------------------------------------------

mpirun detected that one or more processes exited with non-zero status, thus causing

the job to be terminated. The first process to do so was:



  Process name: [[41456,1],0]

  Exit code:    1

--------------------------------------------------------------------------

) (at easybuild/framework/easyblock.py:3655 in _sanity_check_step)

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laraPPr commented Nov 16, 2023

All three failed with the same error ERROR: Lost atoms: original 361 current 360 (src/thermo.cpp:481). So kokkos mappin should now be in order.
New pr to easybuild to fix the failing snity check easybuilders/easybuild-easyconfigs#19246

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bot: build repo:eessi-hpc.org-2023.06-software arch:aarch64/neoverse_v1

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entries: 9994
modules under 2023.06/software/linux/aarch64/neoverse_v1/modules/all
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kim-api/2.3.0-GCCcore-11.2.0.lua
LAMMPS/23Jun2022-foss-2021b-kokkos.lua
PLUMED/2.7.3-foss-2021b.lua
Voro++/0.4.6-GCCcore-11.2.0.lua
VTK/9.1.0-foss-2021b.lua
xxd/8.2.4220-GCCcore-11.2.0.lua
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kim-api/2.3.0-GCCcore-11.2.0
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entries: 9994
modules under 2023.06/software/linux/aarch64/neoverse_n1/modules/all
archspec/0.1.3-GCCcore-11.2.0.lua
kim-api/2.3.0-GCCcore-11.2.0.lua
LAMMPS/23Jun2022-foss-2021b-kokkos.lua
PLUMED/2.7.3-foss-2021b.lua
Voro++/0.4.6-GCCcore-11.2.0.lua
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  • arch x86_64/intel/skylake_avx512 for repo eessi-hpc.org-2023.06-software
  • arch x86_64/intel/skylake_avx512 for repo eessi.io-2023.06-compat
  • arch x86_64/intel/skylake_avx512 for repo eessi.io-2023.06-software
  • arch x86_64/amd/zen2 for repo eessi-hpc.org-2023.06-compat
  • arch x86_64/amd/zen2 for repo eessi-hpc.org-2023.06-software
  • arch x86_64/amd/zen2 for repo eessi.io-2023.06-compat
  • arch x86_64/amd/zen2 for repo eessi.io-2023.06-software
  • arch x86_64/amd/zen3 for repo eessi-hpc.org-2023.06-compat
  • arch x86_64/amd/zen3 for repo eessi-hpc.org-2023.06-software
  • arch x86_64/amd/zen3 for repo eessi.io-2023.06-compat
  • arch x86_64/amd/zen3 for repo eessi.io-2023.06-software
  • arch aarch64/generic for repo eessi-hpc.org-2023.06-compat
  • arch aarch64/generic for repo eessi-hpc.org-2023.06-software
  • arch aarch64/generic for repo eessi.io-2023.06-compat
  • arch aarch64/generic for repo eessi.io-2023.06-software
  • arch aarch64/neoverse_n1 for repo eessi-hpc.org-2023.06-compat
  • arch aarch64/neoverse_n1 for repo eessi-hpc.org-2023.06-software
  • arch aarch64/neoverse_n1 for repo eessi.io-2023.06-compat
  • arch aarch64/neoverse_n1 for repo eessi.io-2023.06-software
  • arch aarch64/neoverse_v1 for repo eessi-hpc.org-2023.06-compat
  • arch aarch64/neoverse_v1 for repo eessi-hpc.org-2023.06-software
  • arch aarch64/neoverse_v1 for repo eessi.io-2023.06-compat
  • arch aarch64/neoverse_v1 for repo eessi.io-2023.06-software

@laraPPr
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laraPPr commented Nov 16, 2023

bot: build repo:eessi-hpc.org-2023.06-software arch:x86_64/generic
bot: build repo:eessi-hpc.org-2023.06-software arch:x86_64/intel/haswell
bot: build repo:eessi-hpc.org-2023.06-software arch:x86_64/intel/skylake_avx512
bot: build repo:eessi-hpc.org-2023.06-software arch:x86_64/amd/zen2
bot: build repo:eessi-hpc.org-2023.06-software arch:x86_64/amd/zen3

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eessi-bot bot commented Nov 16, 2023

Updates by the bot instance eessi-bot-mc-aws (click for details)
  • received bot command build repo:eessi-hpc.org-2023.06-software arch:x86_64/generic from laraPPr

    • expanded format: build repository:eessi-hpc.org-2023.06-software architecture:x86_64/generic
  • received bot command build repo:eessi-hpc.org-2023.06-software arch:x86_64/intel/haswell from laraPPr

    • expanded format: build repository:eessi-hpc.org-2023.06-software architecture:x86_64/intel/haswell
  • received bot command build repo:eessi-hpc.org-2023.06-software arch:x86_64/intel/skylake_avx512 from laraPPr

    • expanded format: build repository:eessi-hpc.org-2023.06-software architecture:x86_64/intel/skylake_avx512
  • received bot command build repo:eessi-hpc.org-2023.06-software arch:x86_64/amd/zen2 from laraPPr

    • expanded format: build repository:eessi-hpc.org-2023.06-software architecture:x86_64/amd/zen2
  • received bot command build repo:eessi-hpc.org-2023.06-software arch:x86_64/amd/zen3 from laraPPr

    • expanded format: build repository:eessi-hpc.org-2023.06-software architecture:x86_64/amd/zen3
  • handling command build repository:eessi-hpc.org-2023.06-software architecture:x86_64/generic resulted in:

  • handling command build repository:eessi-hpc.org-2023.06-software architecture:x86_64/intel/haswell resulted in:

  • handling command build repository:eessi-hpc.org-2023.06-software architecture:x86_64/intel/skylake_avx512 resulted in:

  • handling command build repository:eessi-hpc.org-2023.06-software architecture:x86_64/amd/zen2 resulted in:

  • handling command build repository:eessi-hpc.org-2023.06-software architecture:x86_64/amd/zen3 resulted in:

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eessi-bot bot commented Nov 16, 2023

New job on instance eessi-bot-mc-aws for architecture x86_64-generic for repository eessi-hpc.org-2023.06-software in job dir /project/def-users/SHARED/jobs/2023.11/pr_360/838

date job status comment
Nov 16 21:48:08 UTC 2023 submitted job id 838 awaits release by job manager
Nov 16 21:48:45 UTC 2023 released job awaits launch by Slurm scheduler
Nov 16 21:49:56 UTC 2023 running job 838 is running
Nov 16 23:29:23 UTC 2023 finished
😁 SUCCESS (click triangle for details)
Details
✅ job output file slurm-838.out
✅ no message matching ERROR:
✅ no message matching FAILED:
✅ no message matching required modules missing:
✅ found message(s) matching No missing installations
✅ found message matching .tar.gz created!
Artefacts
eessi-2023.06-software-linux-x86_64-generic-1700177235.tar.gzsize: 219 MiB (230525133 bytes)
entries: 11378
modules under 2023.06/software/linux/x86_64/generic/modules/all
archspec/0.1.3-GCCcore-11.2.0.lua
kim-api/2.3.0-GCCcore-11.2.0.lua
LAMMPS/23Jun2022-foss-2021b-kokkos.lua
PLUMED/2.7.3-foss-2021b.lua
ScaFaCoS/1.0.1-foss-2021b.lua
tbb/2020.3-GCCcore-11.2.0.lua
Voro++/0.4.6-GCCcore-11.2.0.lua
VTK/9.1.0-foss-2021b.lua
xxd/8.2.4220-GCCcore-11.2.0.lua
software under 2023.06/software/linux/x86_64/generic/software
archspec/0.1.3-GCCcore-11.2.0
kim-api/2.3.0-GCCcore-11.2.0
LAMMPS/23Jun2022-foss-2021b-kokkos
PLUMED/2.7.3-foss-2021b
ScaFaCoS/1.0.1-foss-2021b
tbb/2020.3-GCCcore-11.2.0
Voro++/0.4.6-GCCcore-11.2.0
VTK/9.1.0-foss-2021b
xxd/8.2.4220-GCCcore-11.2.0
other under 2023.06/software/linux/x86_64/generic
.lmod/cache/spiderT.lua
.lmod/cache/spiderT.luac_5.1
.lmod/cache/timestamp
Nov 17 10:45:49 UTC 2023 uploaded transfer of eessi-2023.06-software-linux-x86_64-generic-1700177235.tar.gz to S3 bucket succeeded

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eessi-bot bot commented Nov 16, 2023

New job on instance eessi-bot-mc-aws for architecture x86_64-intel-haswell for repository eessi-hpc.org-2023.06-software in job dir /project/def-users/SHARED/jobs/2023.11/pr_360/839

date job status comment
Nov 16 21:48:14 UTC 2023 submitted job id 839 awaits release by job manager
Nov 16 21:48:49 UTC 2023 released job awaits launch by Slurm scheduler
Nov 16 21:54:23 UTC 2023 running job 839 is running
Nov 16 23:36:41 UTC 2023 finished
😁 SUCCESS (click triangle for details)
Details
✅ job output file slurm-839.out
✅ no message matching ERROR:
✅ no message matching FAILED:
✅ no message matching required modules missing:
✅ found message(s) matching No missing installations
✅ found message matching .tar.gz created!
Artefacts
eessi-2023.06-software-linux-x86_64-intel-haswell-1700177684.tar.gzsize: 221 MiB (232555781 bytes)
entries: 11378
modules under 2023.06/software/linux/x86_64/intel/haswell/modules/all
archspec/0.1.3-GCCcore-11.2.0.lua
kim-api/2.3.0-GCCcore-11.2.0.lua
LAMMPS/23Jun2022-foss-2021b-kokkos.lua
PLUMED/2.7.3-foss-2021b.lua
ScaFaCoS/1.0.1-foss-2021b.lua
tbb/2020.3-GCCcore-11.2.0.lua
Voro++/0.4.6-GCCcore-11.2.0.lua
VTK/9.1.0-foss-2021b.lua
xxd/8.2.4220-GCCcore-11.2.0.lua
software under 2023.06/software/linux/x86_64/intel/haswell/software
archspec/0.1.3-GCCcore-11.2.0
kim-api/2.3.0-GCCcore-11.2.0
LAMMPS/23Jun2022-foss-2021b-kokkos
PLUMED/2.7.3-foss-2021b
ScaFaCoS/1.0.1-foss-2021b
tbb/2020.3-GCCcore-11.2.0
Voro++/0.4.6-GCCcore-11.2.0
VTK/9.1.0-foss-2021b
xxd/8.2.4220-GCCcore-11.2.0
other under 2023.06/software/linux/x86_64/intel/haswell
.lmod/cache/spiderT.lua
.lmod/cache/spiderT.luac_5.1
.lmod/cache/timestamp
Nov 17 10:46:13 UTC 2023 uploaded transfer of eessi-2023.06-software-linux-x86_64-intel-haswell-1700177684.tar.gz to S3 bucket succeeded

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eessi-bot bot commented Nov 16, 2023

New job on instance eessi-bot-mc-aws for architecture x86_64-intel-skylake_avx512 for repository eessi-hpc.org-2023.06-software in job dir /project/def-users/SHARED/jobs/2023.11/pr_360/840

date job status comment
Nov 16 21:48:17 UTC 2023 submitted job id 840 awaits release by job manager
Nov 16 21:48:52 UTC 2023 released job awaits launch by Slurm scheduler
Nov 16 21:55:38 UTC 2023 running job 840 is running
Nov 16 23:21:41 UTC 2023 finished
😁 SUCCESS (click triangle for details)
Details
✅ job output file slurm-840.out
✅ no message matching ERROR:
✅ no message matching FAILED:
✅ no message matching required modules missing:
✅ found message(s) matching No missing installations
✅ found message matching .tar.gz created!
Artefacts
eessi-2023.06-software-linux-x86_64-intel-skylake_avx512-1700176803.tar.gzsize: 221 MiB (232347610 bytes)
entries: 11378
modules under 2023.06/software/linux/x86_64/intel/skylake_avx512/modules/all
archspec/0.1.3-GCCcore-11.2.0.lua
kim-api/2.3.0-GCCcore-11.2.0.lua
LAMMPS/23Jun2022-foss-2021b-kokkos.lua
PLUMED/2.7.3-foss-2021b.lua
ScaFaCoS/1.0.1-foss-2021b.lua
tbb/2020.3-GCCcore-11.2.0.lua
Voro++/0.4.6-GCCcore-11.2.0.lua
VTK/9.1.0-foss-2021b.lua
xxd/8.2.4220-GCCcore-11.2.0.lua
software under 2023.06/software/linux/x86_64/intel/skylake_avx512/software
archspec/0.1.3-GCCcore-11.2.0
kim-api/2.3.0-GCCcore-11.2.0
LAMMPS/23Jun2022-foss-2021b-kokkos
PLUMED/2.7.3-foss-2021b
ScaFaCoS/1.0.1-foss-2021b
tbb/2020.3-GCCcore-11.2.0
Voro++/0.4.6-GCCcore-11.2.0
VTK/9.1.0-foss-2021b
xxd/8.2.4220-GCCcore-11.2.0
other under 2023.06/software/linux/x86_64/intel/skylake_avx512
.lmod/cache/spiderT.lua
.lmod/cache/spiderT.luac_5.1
.lmod/cache/timestamp
Nov 17 10:46:58 UTC 2023 uploaded transfer of eessi-2023.06-software-linux-x86_64-intel-skylake_avx512-1700176803.tar.gz to S3 bucket succeeded

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eessi-bot bot commented Nov 16, 2023

New job on instance eessi-bot-mc-aws for architecture x86_64-amd-zen2 for repository eessi-hpc.org-2023.06-software in job dir /project/def-users/SHARED/jobs/2023.11/pr_360/841

date job status comment
Nov 16 21:48:21 UTC 2023 submitted job id 841 awaits release by job manager
Nov 16 21:48:38 UTC 2023 released job awaits launch by Slurm scheduler
Nov 16 21:53:05 UTC 2023 running job 841 is running
Nov 16 23:25:03 UTC 2023 finished
😁 SUCCESS (click triangle for details)
Details
✅ job output file slurm-841.out
✅ no message matching ERROR:
✅ no message matching FAILED:
✅ no message matching required modules missing:
✅ found message(s) matching No missing installations
✅ found message matching .tar.gz created!
Artefacts
eessi-2023.06-software-linux-x86_64-amd-zen2-1700177013.tar.gzsize: 220 MiB (231001200 bytes)
entries: 11378
modules under 2023.06/software/linux/x86_64/amd/zen2/modules/all
archspec/0.1.3-GCCcore-11.2.0.lua
kim-api/2.3.0-GCCcore-11.2.0.lua
LAMMPS/23Jun2022-foss-2021b-kokkos.lua
PLUMED/2.7.3-foss-2021b.lua
ScaFaCoS/1.0.1-foss-2021b.lua
tbb/2020.3-GCCcore-11.2.0.lua
Voro++/0.4.6-GCCcore-11.2.0.lua
VTK/9.1.0-foss-2021b.lua
xxd/8.2.4220-GCCcore-11.2.0.lua
software under 2023.06/software/linux/x86_64/amd/zen2/software
archspec/0.1.3-GCCcore-11.2.0
kim-api/2.3.0-GCCcore-11.2.0
LAMMPS/23Jun2022-foss-2021b-kokkos
PLUMED/2.7.3-foss-2021b
ScaFaCoS/1.0.1-foss-2021b
tbb/2020.3-GCCcore-11.2.0
Voro++/0.4.6-GCCcore-11.2.0
VTK/9.1.0-foss-2021b
xxd/8.2.4220-GCCcore-11.2.0
other under 2023.06/software/linux/x86_64/amd/zen2
.lmod/cache/spiderT.lua
.lmod/cache/spiderT.luac_5.1
.lmod/cache/timestamp
Nov 17 10:47:21 UTC 2023 uploaded transfer of eessi-2023.06-software-linux-x86_64-amd-zen2-1700177013.tar.gz to S3 bucket succeeded

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eessi-bot bot commented Nov 16, 2023

New job on instance eessi-bot-mc-aws for architecture x86_64-amd-zen3 for repository eessi-hpc.org-2023.06-software in job dir /project/def-users/SHARED/jobs/2023.11/pr_360/842

date job status comment
Nov 16 21:48:25 UTC 2023 submitted job id 842 awaits release by job manager
Nov 16 21:48:41 UTC 2023 released job awaits launch by Slurm scheduler
Nov 16 21:53:09 UTC 2023 running job 842 is running
Nov 16 23:14:40 UTC 2023 finished
😁 SUCCESS (click triangle for details)
Details
✅ job output file slurm-842.out
✅ no message matching ERROR:
✅ no message matching FAILED:
✅ no message matching required modules missing:
✅ found message(s) matching No missing installations
✅ found message matching .tar.gz created!
Artefacts
eessi-2023.06-software-linux-x86_64-amd-zen3-1700176357.tar.gzsize: 220 MiB (231101792 bytes)
entries: 11378
modules under 2023.06/software/linux/x86_64/amd/zen3/modules/all
archspec/0.1.3-GCCcore-11.2.0.lua
kim-api/2.3.0-GCCcore-11.2.0.lua
LAMMPS/23Jun2022-foss-2021b-kokkos.lua
PLUMED/2.7.3-foss-2021b.lua
ScaFaCoS/1.0.1-foss-2021b.lua
tbb/2020.3-GCCcore-11.2.0.lua
Voro++/0.4.6-GCCcore-11.2.0.lua
VTK/9.1.0-foss-2021b.lua
xxd/8.2.4220-GCCcore-11.2.0.lua
software under 2023.06/software/linux/x86_64/amd/zen3/software
archspec/0.1.3-GCCcore-11.2.0
kim-api/2.3.0-GCCcore-11.2.0
LAMMPS/23Jun2022-foss-2021b-kokkos
PLUMED/2.7.3-foss-2021b
ScaFaCoS/1.0.1-foss-2021b
tbb/2020.3-GCCcore-11.2.0
Voro++/0.4.6-GCCcore-11.2.0
VTK/9.1.0-foss-2021b
xxd/8.2.4220-GCCcore-11.2.0
other under 2023.06/software/linux/x86_64/amd/zen3
.lmod/cache/spiderT.lua
.lmod/cache/spiderT.luac_5.1
.lmod/cache/timestamp
Nov 17 10:46:35 UTC 2023 uploaded transfer of eessi-2023.06-software-linux-x86_64-amd-zen3-1700176357.tar.gz to S3 bucket succeeded

@laraPPr laraPPr added the ready-to-deploy Mark a PR as ready to deploy label Nov 16, 2023
@boegel boegel added bot:deploy Ask bot to deploy missing software installations to EESSI and removed ready-to-deploy Mark a PR as ready to deploy labels Nov 17, 2023
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Lgtm, thanks for the effort in solving all the aarch64 issues @laraPPr!

@bedroge bedroge merged commit ba585ee into EESSI:2023.06 Nov 17, 2023
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TopRichard pushed a commit to TopRichard/bot-software-layer1 that referenced this pull request May 8, 2024
…ate_tarball

Modify create_tarball.sh to address changes under init
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6 participants