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Fix relaxation termination summary status - #8226

Merged

mohanchen merged 16 commits into

deepmodeling:developfrom

19hello:fix/issue8087

Oct 31, 2026

Merged

Fix relaxation termination summary status#8226
mohanchen merged 16 commits into
deepmodeling:developfrom
19hello:fix/issue8087

Commits on Oct 28, 2026
- Fix relaxation termination summary status
  Fei Yang
  committed
  8883cd0
- style: keep relax dry-run condition on one line
  Fei Yang
  committed
  5c1317d
- refactor: remove unused relaxation running state
  Fei Yang
  committed
  652b6cc
- refactor: derive reported relaxation steps
  Fei Yang
  committed
  3aac8b6
Commits on Oct 29, 2026
- fix: prevent unevaluated final relaxation geometry
  Fei Yang
  committed
  2143641
- refactor: pass relaxation criteria to traditional bfgs
  Fei Yang
  committed
  8e8cee7
- fix: preserve final relaxed coordinates
  Fei Yang
  committed
  a83bfb5
- style: restore unchanged lattice change files
  Fei Yang
  committed
  a7f1461
- test: cover relaxation driver stop states
  Fei Yang
  committed
  17c51c2
- fix: link JSON sources in relax driver test
  Fei Yang
  committed
  2e2843e
- fix: build input documentation without full ABACUS install
  Fei Yang
  committed
  4d5cd57
Commits on Oct 30, 2026
- Revert "fix: build input documentation without full ABACUS install"
  Fei Yang
  committed
  ada1311
- fix: reset relaxation geometry update state
  Fei Yang
  committed
  a198f26
- fix: run final relaxation postprocessing on evaluated geometry
  Fei Yang
  committed
  65e8be5
Commits on Oct 31, 2026
- test: initialize MPI in relaxation driver test
  Fei Yang
  committed
  850b2bf
- test: use shared MPI test main for relax driver
  Fei Yang
  committed
  6ccff1a