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Commits on Dec 11, 2024

• Update physical_property.py (#157)

  Show description for 0c0caad
  TLCFEM

  authored
  0c0caad

Commits on Nov 18, 2024

• Bump dependencies (#147)

  Show description for 50154d5
  

  ndaelman-hu

  and

  ndaelman

  authored
  50154d5

Commits on Nov 4, 2024

• Fix shape mismatch of bond_list in model_system (#145)

  Show description for a398c0a
  Bernadette-Mohr

  authored
  a398c0a

Commits on Oct 16, 2024

• Extend equalities with comparison (#122)

  Show description for 20d2fb2
  

  ndaelman-hu

  and

  ndaelman

  authored
  20d2fb2

Commits on Sep 30, 2024

• Add some methods for the cell (#140)

  Show description for 8b360d2
  JosePizarro3

  authored
  8b360d2

Commits on Sep 27, 2024

• Define n_atoms_per_unit_cell for TB model method (#139)

  Show description for 0b6c6cd
  JosePizarro3

  authored
  0b6c6cd

Commits on Sep 25, 2024

• added zenodo doi (#135)

  Show description for 001ea5e
  

  JFRudzinski

  and

  jrudz

  authored
  001ea5e

• 126 minor fixes (#127)

  Show description for 5d162aa
  JosePizarro3

  authored
  5d162aa

Commits on Sep 24, 2024

• added cff file for Zenodo publishing (#128)

  Show description for 349d80f
  

  JFRudzinski

  and

  jrudz

  authored
  349d80f

Commits on Sep 18, 2024

• Added check_simulation_cell in utils (#117)

  Show description for 96f4a91
  JosePizarro3

  authored
  96f4a91

Commits on Sep 17, 2024

• 115 issues with dft xc extraction (#119)

  Show description for 8cf4685
  

  ndaelman-hu

  and

  ndaelman

  authored
  8cf4685

Commits on Sep 13, 2024

• Add protection to model_system normalization in case the list is empty (#118)

  Show description for cab1353
  

  ndaelman-hu

  and

  ndaelman

  authored
  cab1353

Commits on Sep 11, 2024

• ruff (#116)

  Show description for 30192c0
  

  JFRudzinski

  and

  jrudz

  authored
  30192c0

Commits on Sep 10, 2024

• Add subroutine_name_internal quantity (#112)

  Show description for ade5ec2
  

  ndaelman-hu

  and

  ndaelman

  authored
  ade5ec2

Commits on Sep 6, 2024

• Update link (#111)

  Show description for 3a5d2c0
  

  ndaelman-hu

  and

  ndaelman

  authored
  3a5d2c0

Commits on Aug 27, 2024

• 101 complete basis set migration (#102)

  Show description for e49c438
  

  3 peopleauthored
  e49c438

• Add ElectronicGreensFunction and ElectronicSelfEnergy properties (#109)

  Show description for 90c99bc
  JosePizarro3

  authored
  90c99bc

Commits on Aug 23, 2024

• Enforcing 3.11 for building

  JosePizarro3

  committed
  ffe8637

Commits on Aug 20, 2024

• Fix Esma email

  JosePizarro3

  authored
  b137d03

• Adding Esma to contributors and small hotfix

  JosePizarro3

  authored
  5ba8eb9

• Deleting index url from pip installation instructions in README.md

  JosePizarro3

  authored
  7582f30

Commits on Aug 15, 2024

• Allowing 3.11 python version (#107)

  Show description for 4527342
  JosePizarro3

  authored
  4527342

Commits on Jul 8, 2024

• Adding isort and other rules for formatting (#99)

  Show description for bd2f695
  JosePizarro3

  authored
  bd2f695

• create base structure for energies (#91)

  Show description for 0e5707f
  

  JFRudzinski

  and

  jrudz

  authored
  0e5707f

Commits on Jul 2, 2024

• Fixing repo for release (#97)

  Show description for 50fc8bd
  JosePizarro3

  authored
  50fc8bd

Commits on Jul 1, 2024

• Hotfix imports utils

  JosePizarro3

  committed
  97487d2

Commits on Jun 29, 2024

• Update README.md

  JosePizarro3

  authored
  a8f7cba

Commits on Jun 28, 2024

• Further abstraction in ModelMethod (#93)

  Show description for ceef830
  JosePizarro3

  authored
  ceef830

Commits on Jun 27, 2024

• Added back vscode/settings.json

  JosePizarro3

  committed
  774cc73

• Fix README (#95)

  Show description for d24c80b
  JosePizarro3

  authored
  d24c80b

Commits on Jun 25, 2024

• Version tag (#90)

  Show description for 2c2f2fd
  JosePizarro3

  authored
  2c2f2fd

• Adapting new entry points structure (#88)

  Show description for dbdca1f
  JosePizarro3

  authored
  dbdca1f

Commits on Jun 6, 2024

• Add missing pip install coveralls

  JosePizarro3

  committed
  00483ec

• Fix github actions to include submission to Coveralls for badge

  JosePizarro3

  committed
  59e9421

• Add unit testing (#84)

  Show description for 73ddc7f
  JosePizarro3

  authored
  73ddc7f

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