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Add APEX Skill and Update Gamma Surface with New Features - #122

Merged

kevinwenminion merged 31 commits into

deepmodeling:devel-1.3.0from

Zikkying:devel-1.3.0

Jul 20, 2026

Merged

Add APEX Skill and Update Gamma Surface with New Features#122
kevinwenminion merged 31 commits into
deepmodeling:devel-1.3.0from
Zikkying:devel-1.3.0

Commits on Jul 7, 2026
- phonopy v4.1.0 compatible check
  Zikkying
  committed
  720ef4a
Commits on Jul 14, 2026
- Add apex-flow Cursor skill for APEX workflow orchestration
  
  letian
  and
  cursoragent
  committed
  eb5da9e
- Merge pull request #3 from Letian88/devel-1.3.0
  Zikkying
  authored
  41166fb
Commits on Jul 16, 2026
- Ship apex-skill package with combo screening and env project ID
  
  Zikkying
  and
  cursoragent
  committed
  3b9102a
- Harden apex-skill workflow guidance and packaging
  
  Zikkying
  and
  cursoragent
  committed
  3943547
- Improve gamma-surface workflow robustness
  Zikkying
  committed
  1332cbd
- rename skill name from apex-skill to apex-flow
  Zikkying
  committed
  f4c4ca6
- shorten prompt
  Zikkying
  committed
  28516da
- Agent default use submit -s for saving
  Zikkying
  committed
  cf1a1fd
- Fix phonon displacement task ordering
  
  Zikkying
  and
  cursoragent
  committed
  5fd4f29
Commits on Jul 17, 2026
- Update DeepMD-kit with phonolammps supported docker. Now Default Docker image is deepmd-kit-phonolammps:3.1.3
  Zikkying
  committed
  9e06672
- Merge deepmodeling/devel-1.3.0 into PR branch
  
  Zikkying
  and
  cursoragent
  committed
  60177f5
- Bump package version to 1.3.0.post2
  
  Zikkying
  and
  cursoragent
  committed
  db79d57
- Use blocking APEX skill submissions
  
  Zikkying
  and
  cursoragent
  committed
  b868abf
- Replace bundled DPA2 model with DPA-3.2-5M
  
  Zikkying
  and
  cursoragent
  committed
  01db0d6
- Update default APEX image to post2
  
  Zikkying
  and
  cursoragent
  committed
  eccaf14
- Test apex-flow skill configuration scripts
  
  Zikkying
  and
  cursoragent
  committed
  e3052eb
Commits on Jul 18, 2026
- Validate Bohrium project IDs before submission
  
  Zikkying
  and
  cursoragent
  committed
  8e15fdf
- Fix Grüneisen support for Phonopy 4
  
  Zikkying
  and
  cursoragent
  committed
  bdcee37
- Enhance RSS Workflow and Configuration Management
  Zikkying
  committed
  b024e51
- Fix decohesive slabs for tilted lattice vectors
  
  Zikkying
  and
  cursoragent
  committed
  63afad7
- Release apex-flow 1.3.0.post3
  
  Zikkying
  and
  cursoragent
  committed
  3a47016
- Force upgrade latest apex
  Zikkying
  committed
  ccc9e1c
- Ensure decohesive slabs stay right-handed for LAMMPS.
  
  Zikkying
  and
  cursoragent
  committed
  0cb370f
Commits on Jul 19, 2026
- Harden apex-flow skill for batch jobs, RSS, and VASP POTCAR uploads.
  
  Zikkying
  and
  cursoragent
  committed
  9a90b05
- Release apex-flow 1.3.0.post4 and switch default Bohrium image to 1.3.0.post.
  
  Zikkying
  and
  cursoragent
  committed
  e8af1b4
- Fix skill script test for default VASP potcar_prefix.
  
  Zikkying
  and
  cursoragent
  committed
  c80a9d5
- Stage VASP POTCARs into job root with potcar_prefix '.'.
  
  Zikkying
  and
  cursoragent
  committed
  b5a253c
- Fix validate_interaction test for required VASP potcar_prefix.
  
  Zikkying
  and
  cursoragent
  committed
  b639671
- Require DFT k-spacing and license-gated VASP image discovery.
  
  Zikkying
  and
  cursoragent
  committed
  48c7914
- Release apex-flow 1.3.0.post5.
  
  Zikkying
  and
  cursoragent
  committed
  966ccca

Commits

Commits on Jul 7, 2026

Commits on Jul 14, 2026

Commits on Jul 16, 2026

Commits on Jul 17, 2026

Commits on Jul 18, 2026

Commits on Jul 19, 2026