Code

Add support for AiiDA 2#5

Code

Merged

scemama merged 54 commits intoTREX-CoE:masterTREX-CoE/aiida-qp2:masterfrom addman2:aiida2addman2/aiida-qp2:aiida2Copy head branch name to clipboardMay 29, 2024

+5,054-89

Commits

Commits on Feb 26, 2024

• WIP

  addman2

  committed
  bd40543

  Copy full SHA for bd40543

• Add parser 'create'

  addman2

  committed
  1b83918

  Copy full SHA for 1b83918

• update setup.json

  addman2

  committed
  c477c1c

  Copy full SHA for c477c1c

• WIP

  addman2

  committed
  174094a

  Copy full SHA for 174094a

• Add frist test

  addman2

  committed
  5ed9a91

  Copy full SHA for 5ed9a91

• WIP

  addman2

  committed
  937b96c

  Copy full SHA for 937b96c

Commits on Feb 27, 2024

• Update git ignore, Sort

  addman2

  committed
  b52f1a3

  Copy full SHA for b52f1a3

• Update git ignore, Sort

  addman2

  committed
  bad31a2

  Copy full SHA for bad31a2

• clean up pk_decorator

  addman2

  committed
  9f07420

  Copy full SHA for 9f07420

• WIP

  addman2

  committed
  1486724

  Copy full SHA for 1486724

Commits on Feb 28, 2024

• WIP

  addman2

  committed
  0755a3d

  Copy full SHA for 0755a3d

• WIP

  addman2

  committed
  06329c3

  Copy full SHA for 06329c3

• WIP

  addman2

  committed
  f997a98

  Copy full SHA for f997a98

• Add dry-run no-save-wf options to run

  addman2

  committed
  905cc00

  Copy full SHA for 905cc00

Commits on Feb 29, 2024

• Add anthor gitignore

  addman2

  committed
  8cf98f9

  Copy full SHA for 8cf98f9

• QMC=Chem now works

  addman2

  committed
  d571da7

  Copy full SHA for d571da7

• Merge pull request #1 from addman2/add_qmcchem

  Show description for dd1e33e
  addman2

  authored
  dd1e33e

  Copy full SHA for dd1e33e

Commits on Mar 1, 2024

• WIP

  addman2

  committed
  3af54e0

  Copy full SHA for 3af54e0

• Merge pull request #2 from addman2/add_qmcchem

  Show description for 7d6e238
  addman2

  authored
  7d6e238

  Copy full SHA for 7d6e238

• Add dump command

  addman2

  committed
  62157c4

  Copy full SHA for 62157c4

• Merge branch 'add_qmcchem' into aiida2

  addman2

  committed
  f95be7c

  Copy full SHA for f95be7c

• WIP

  addman2

  committed
  a87501a

  Copy full SHA for a87501a

• Fix strange name of cli function

  addman2

  committed
  57555f2

  Copy full SHA for 57555f2

• Add extract option

  addman2

  committed
  93cb00e

  Copy full SHA for 93cb00e

• Add output command

  addman2

  committed
  3f2e477

  Copy full SHA for 3f2e477

Commits on Mar 2, 2024

• Add # WFs in list

  addman2

  committed
  adb5db9

  Copy full SHA for adb5db9

• Move dumping command to new dump group

  addman2

  committed
  e45f05a

  Copy full SHA for e45f05a

• Add console script

  addman2

  committed
  866692a

  Copy full SHA for 866692a

Commits on Mar 3, 2024

• Fix proglem with aqp and loading profile

  addman2

  committed
  1eaf962

  Copy full SHA for 1eaf962

• Fix number of wf in list command

  addman2

  committed
  9cc161d

  Copy full SHA for 9cc161d

• Add sotrage of blocks

  addman2

  committed
  a26d923

  Copy full SHA for a26d923

• Clean up cli client

  addman2

  committed
  a855524

  Copy full SHA for a855524

• Add interactive editor

  addman2

  committed
  8e38add

  Copy full SHA for 8e38add

• Add Edditing from file

  addman2

  committed
  5c4efe8

  Copy full SHA for 5c4efe8

Commits on Mar 5, 2024

• Typos

  addman2

  committed
  dad5459

  Copy full SHA for dad5459

• Refactoring

  addman2

  committed
  8c606db

  Copy full SHA for 8c606db

• Add info about code completion

  addman2

  committed
  bf66cf1

  Copy full SHA for bf66cf1

• ammend

  addman2

  committed
  b53bcfa

  Copy full SHA for b53bcfa

• Features in show

  addman2

  committed
  3779f87

  Copy full SHA for 3779f87

• Add info about dcoer images

  addman2

  committed
  8a7f94b

  Copy full SHA for 8a7f94b

• Add highliting of most recent wf

  addman2

  committed
  4c40192

  Copy full SHA for 4c40192

• Promting to activate project

  addman2

  committed
  959043b

  Copy full SHA for 959043b

• Make output nicer

  addman2

  committed
  0fe3df1

  Copy full SHA for 0fe3df1

• Add jast_opt example

  addman2

  committed
  0a2b323

  Copy full SHA for 0a2b323

• Add workflow command

  addman2

  committed
  b9069d1

  Copy full SHA for b9069d1

• Fix minor bug

  addman2

  committed
  95e374c

  Copy full SHA for 95e374c

• README

  scemama

  committed
  0e0fe11

  Copy full SHA for 0e0fe11

Commits on Mar 18, 2024

• Add gprah show

  addman2

  committed
  330f46e

  Copy full SHA for 330f46e

Commits on Mar 19, 2024

• Minor changes

  scemama

  committed
  8d48d95

  Copy full SHA for 8d48d95

• Merge branch 'aiida2' of github.com:addman2/aiida-qp2 into aiida2

  scemama

  committed
  d7296c4

  Copy full SHA for d7296c4

• Merge pull request #3 from scemama/aiida2

  Show description for 26178e2
  addman2

  authored
  26178e2

  Copy full SHA for 26178e2

Commits on May 28, 2024

• Remove reentry scan

  addman2

  committed
  2078012

  Copy full SHA for 2078012

• Remove docs from CI (temporary)

  addman2

  committed
  c448780

  Copy full SHA for c448780

• FIx precommit

  addman2

  committed
  d2921d0

  Copy full SHA for d2921d0