Commits

Commit history

1. Commits on Sep 30, 2026

   • Parallel DFT-D4 with MPI through work-partition (#8041)

     Growl1234

     authored
     43a4a2aView commit details

     Copy full SHA for 43a4a2a

     View code at this pointBrowse repository at this point
2. Commits on Sep 27, 2026

   • Toolchain: Remove OpenBLAS-based architecture detection (#7971)

     Growl1234

     authored
     1dd2b80View commit details

     Copy full SHA for 1dd2b80

     View code at this pointBrowse repository at this point
3. Commits on Sep 18, 2026

   • Refactor: Replace RapidJSON with nlohmann-json (#7979)

     Growl1234

     authored
     a3c8442View commit details

     Copy full SHA for a3c8442

     View code at this pointBrowse repository at this point
4. Commits on Aug 13, 2026

   • feat: add BSE module (#7718)

     Show description for 1e4c1c6
     Fisherd99

     authored
     1e4c1c6View commit details

     Copy full SHA for 1e4c1c6

     View code at this pointBrowse repository at this point
5. Commits on Aug 9, 2026

   • Toolchain: Workaround incorrect ELPA results with GCC 15.2 (#7784)

     Growl1234

     authored
     feb6eddView commit details

     Copy full SHA for feb6edd

     View code at this pointBrowse repository at this point
6. Commits on Jul 29, 2026

   • Libxc: 7.0.0 -> 7.1.2 (toolchain); fix external parameter handling (#7655)

     Show description for 83c89c4
     Growl1234

     authored
     83c89c4View commit details

     Copy full SHA for 83c89c4

     View code at this pointBrowse repository at this point
7. Commits on Jul 18, 2026

   • Toolchain: Avoid flooding container logs with download progress (#7618)

     Show description for 4155157
     Growl1234

     authored
     4155157View commit details

     Copy full SHA for 4155157

     View code at this pointBrowse repository at this point
8. Commits on Jul 10, 2026

   • [toolchain] Harden installation failure handling and RapidJSON CMake support (#7583)

     Show description for 86ae025
     

     QuantumMisaka

     and

     mohanchen

     authored
     86ae025View commit details

     Copy full SHA for 86ae025

     View code at this pointBrowse repository at this point
9. Commits on Jul 3, 2026

   • Add FindKML.cmake and resolve FFTW3 issue (#7576)

     Show description for 59dc884
     Growl1234

     authored
     59dc884View commit details

     Copy full SHA for 59dc884

     View code at this pointBrowse repository at this point
10. Commits on Jul 1, 2026

    • Toolchain/CMake: Improve dependency handling (#7449)

      Show description for 33a7acd
      Growl1234

      authored
      33a7acdView commit details

      Copy full SHA for 33a7acd

      View code at this pointBrowse repository at this point
11. Commits on Jun 27, 2026

    • Toolchain: Block installation of prebuilt libtorch when enabling MKL (#7525)

      Show description for 5231beb
      Growl1234

      authored
      5231bebView commit details

      Copy full SHA for 5231beb

      View code at this pointBrowse repository at this point
12. Commits on Jun 5, 2026

    • Add optional DFT-D4 support (#7380)

      Show description for 69a663f
      Growl1234

      authored
      69a663fView commit details

      Copy full SHA for 69a663f

      View code at this pointBrowse repository at this point
13. Commits on May 24, 2026

    • Toolchain: Allow controling parallel jobs for ABACUS build after toolchain setup (#7376)

      Growl1234

      authored
      78fc55cView commit details

      Copy full SHA for 78fc55c

      View code at this pointBrowse repository at this point
14. Commits on May 12, 2026

    • Toolchain: Use "filter_setup" functional for a cleaner setup file (#7319)

      Show description for 32bd415
      Growl1234

      authored
      32bd415View commit details

      Copy full SHA for 32bd415

      View code at this pointBrowse repository at this point
15. Commits on May 7, 2026

    • Toolchain: Fix package installing issue (#7315)

      Show description for b9669d3
      Growl1234

      authored
      b9669d3View commit details

      Copy full SHA for b9669d3

      View code at this pointBrowse repository at this point
16. Commits on May 6, 2026

    • Toolchain 202601 (#7310)

      Show description for 61734d8
      

      QuantumMisaka

      and

      traeagent

      authored
      61734d8View commit details

      Copy full SHA for 61734d8

      View code at this pointBrowse repository at this point
17. Commits on May 5, 2026

    • Refactor: update `#include` in all files (#7289)

      Show description for 78e16d9
      

      linpeize

      and

      PeizeLin

      authored
      78e16d9View commit details

      Copy full SHA for 78e16d9

      View code at this pointBrowse repository at this point
18. Commits on May 2, 2026

    • Toolchain: Remove notice of downloading master branch (#7303)

      Growl1234

      authored
      e2bd830View commit details

      Copy full SHA for e2bd830

      View code at this pointBrowse repository at this point
19. Commits on Apr 30, 2026

    • Toolchain: Packages updating (#7285)

      Show description for 0f9d7d9
      Growl1234

      authored
      0f9d7d9View commit details

      Copy full SHA for 0f9d7d9

      View code at this pointBrowse repository at this point
20. Commits on Apr 17, 2026

    • Add CI/CD workflow for Toolchain (#7244)

      Show description for c2b3b24
      QuantumMisaka

      authored
      c2b3b24View commit details

      Copy full SHA for c2b3b24

      View code at this pointBrowse repository at this point
21. Commits on Apr 13, 2026

    • Toolchain: Remove redundant exporting variables (#7230)

      Show description for d54cc6f
      Growl1234

      authored
      d54cc6fView commit details

      Copy full SHA for d54cc6f

      View code at this pointBrowse repository at this point
22. Commits on Apr 3, 2026

    • Toolchain: Use fixed commit hash instead of master branch (#7193)

      Show description for d26a604
      Growl1234

      authored
      d26a604View commit details

      Copy full SHA for d26a604

      View code at this pointBrowse repository at this point
23. Commits on Mar 23, 2026

    • Fix cereal? (#7116)

      Flying-dragon-boxing

      authored
      c00074aView commit details

      Copy full SHA for c00074a

      View code at this pointBrowse repository at this point
24. Commits on Jan 20, 2026

    • Update source files for NEP installation script (#6871)

      ZhouXY-PKU

      authored
      6ad3b99View commit details

      Copy full SHA for 6ad3b99

      View code at this pointBrowse repository at this point
25. Commits on Jan 17, 2026

    • Optimize install_openmpi.sh script (#6863)

      Show description for 7a09883
      

      19hello

      and

      Fei Yang

      authored
      7a09883View commit details

      Copy full SHA for 7a09883

      View code at this pointBrowse repository at this point
26. Commits on Dec 25, 2025

    • refactor(NEP): Update the name of `NEP` class, and modify the makefile (#6804)

      Show description for 29f141d
      MoseyQAQ

      authored
      29f141dView commit details

      Copy full SHA for 29f141d

      View code at this pointBrowse repository at this point
27. Commits on Nov 19, 2025

    • Toolchain and docs modification (#6718)

      Show description for 917092e
      QuantumMisaka

      authored
      917092eView commit details

      Copy full SHA for 917092e

      View code at this pointBrowse repository at this point
28. Commits on Oct 22, 2025

    • [develop][Toolchain] fix elpa-gpu installation problem in toolchain (#6632)

      Show description for 3e89604
      QuantumMisaka

      authored
      3e89604View commit details

      Copy full SHA for 3e89604

      View code at this pointBrowse repository at this point
29. Commits on Oct 21, 2025

    • [Toolchain] Fix AOCL linking problem and other ver-202503 patch (#6623)

      Show description for e43b1cd
      QuantumMisaka

      authored
      e43b1cdView commit details

      Copy full SHA for e43b1cd

      View code at this pointBrowse repository at this point
30. Commits on Oct 19, 2025

    • Toolchain 202503 Version Update (#6615)

      Show description for 388226b
      

      4 peopleauthored
      388226bView commit details

      Copy full SHA for 388226b

      View code at this pointBrowse repository at this point
31. Commits on Oct 15, 2025

    • [Feature] Add NEP as esolver (#6603)

      Show description for f6e15df
      

      MoseyQAQ

      and

      mohanchen

      authored
      f6e15dfView commit details

      Copy full SHA for f6e15df

      View code at this pointBrowse repository at this point
32. Commits on Aug 26, 2025

    • Toolchain intel update to fix issue #6190 (#6451)

      Show description for 320226d
      

      Kai Luo (罗凯)

      authored
      320226dView commit details

      Copy full SHA for 320226d

      View code at this pointBrowse repository at this point
33. Commits on May 8, 2025

    • [Toolchain] 2025-02 version update (#6189)

      Show description for 5d0949c
      

      QuantumMisaka

      and

      Copilot

      authored
      5d0949cView commit details

      Copy full SHA for 5d0949c

      View code at this pointBrowse repository at this point
34. Commits on Apr 28, 2025

    • Bug fixes for Intel oneapi 2025 for issue #5518 (#6173)

      Show description for e1d44f6
      

      Kai Luo (罗凯)

      authored
      e1d44f6View commit details

      Copy full SHA for e1d44f6

      View code at this pointBrowse repository at this point
35. Commits on Mar 25, 2025

    • [Toolchain] pack-run and package url (#6051)

      Show description for c1c0b0b
      QuantumMisaka

      authored
      c1c0b0bView commit details

      Copy full SHA for c1c0b0b

      View code at this pointBrowse repository at this point