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History for Dockerfile.gnu - samomoyed/abacus-develop · GitHub
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Commits on Nov 19, 2025
Toolchain and docs modification (#6718)
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QuantumMisaka
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Commits on Jun 12, 2025
Refactor: replace ENABLE_DEEPKS & ENABLE_MLKEDF with ENABLE_MLALGO (#6271)
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Commits on May 5, 2024
CI: build images with tags on self-hosted runner (#4089)
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caic99
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Commits on Mar 26, 2024
set ENABLE_RAPIDJSON=ON in dockerfile to output abacus.json (#3788)
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pxlxingliang
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WHUweiqingzhou
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Commits on Jan 26, 2024
Test: Configure performance tests for math libraries (#3511)
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grysgreat
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Commits on Oct 20, 2023
Revert "Build: update Dockerfile.gnu with mpifort for paw test case (#3079)" (#3083)
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hongriTianqi
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Commits on Oct 19, 2023
Build: update Dockerfile.gnu with mpifort for paw test case (#3079)
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hongriTianqi
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Commits on Oct 12, 2023
Test : add gfortran in gnu docker (#3061)
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wenfei-li
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wenfei-li
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Commits on Sep 13, 2023
doc: do not remove abacus codes in Dockerfile (#2937)
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pxlxingliang
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100f46a
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Commits on May 19, 2023
Test : add integrate tests for exx (#2478)
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PeizeLin
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bf111e3
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Commits on Apr 5, 2023
Build!: using icpx in replace of icpc (#2186)
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caic99
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Commits on Feb 8, 2023
Build: enable libxc by default in docker images. (#1865)
caic99
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Commits on Nov 15, 2022
Build: pin OpenBLAS variant to OpenMP (#1505)
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caic99
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Commits on Nov 11, 2022
CI: ensuring docker build to use the latest codes (#1498)
caic99
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Commits on Oct 11, 2022
Build: move libtorch to a separated folder. (#1382)
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caic99
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f588d9e
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Commits on Aug 8, 2022
Build: add executable file to docker image
caic99
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105cf22
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Commits on Jul 12, 2022
Build: add python3 to test image
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18c0100
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Commits on Jul 9, 2022
Build: remove downloaded file
felix5572
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6333de1
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Commits on Jul 8, 2022
Build: refactor dev container
felix5572
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989620d
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Commits on Jun 30, 2022
CI: fix envvars in image for openmpi
caic99
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8c23227
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Adjust mpi impl.
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a9c8f4f
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fix: change ScaLAPACK version to fix memory leaks in matrix diagonalization
Xiaokuang Bai
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50976e1
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Commits on Jun 6, 2022
Build: add numpy for deepks test
caic99
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2ed8dad
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Commits on Jun 2, 2022
Build: add color output for CI image
caic99
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b071562
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Build: add python for CI result parsing. (#962)
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caic99
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72a8460
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Commits on Apr 15, 2022
Build: fix file path of `libnpy`.
caic99
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b2cb896
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Commits on Apr 14, 2022
Build: Add `libnpy`, `googletest` in docker env.
caic99
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5bed959
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Commits on Jan 17, 2022
Fix:Move files.
caic99
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3d270ba
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Commits on Oct 18, 2021
Fix: torch version mismatch with cxx11 abi setting.
caic99
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33daedb
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Commits on Oct 14, 2021
Set openmp default to ON. Add OpenMP flag while building openblas.
caic99
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Commits on Sep 24, 2021
Disable avx512 kernel for cross-compilation issues.
caic99
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4384132
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Commits on Sep 23, 2021
Try to fix avx512 building issues.
caic99
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8b0c06f
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Fix typo
caic99
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2246d19
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Fix mix indent
caic99
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9cf35bc
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Add elpa 21 support to docker images.
caic99
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5fefc08
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