Commits · 92fc4b6370759c28e7aa2549a9888d74330bb56a · Quantum Tinkerer / MeanFi · GitLab

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May 01, 2024
- set up sphinx docs · 92fc4b63
  Kostas Vilkelis authored 10 months ago
  
  92fc4b63
- make package importable · 9831e936
  Kostas Vilkelis authored 10 months ago
  
  9831e936
- Merge branch 'interface-refactoring' into 'main' · da36d81e
  Johanna Zijderveld authored 10 months ago
  
  Draft: Interface refactoring See merge request qt/kwant-scf!4
  da36d81e
- get diatomic molecule (0d example) fully running · b1533370
  Johanna Zijderveld authored 10 months ago
  
  b1533370
- ensure that reshaping array is of correct type · e9427441
  Johanna Zijderveld authored 10 months ago
  
  e9427441
- fix density matrix for 0D · 12febd75
  Kostas Vilkelis authored 10 months ago
  
  12febd75
- refactor to current code (non functional still) · 8e0167ff
  Johanna Zijderveld authored 10 months ago
  
  8e0167ff
- make the flattening functions play nice with 0d too · c80feee3
  Johanna Zijderveld authored 10 months ago
  
  c80feee3
- small changes to get 0d to work · 100514da
  Johanna Zijderveld authored 10 months ago
  
  100514da
- rm lattice from inputs · 510fb6f9
  Kostas Vilkelis authored 10 months ago
  
  510fb6f9
- add test for mexican hat · 1321ab08
  Johanna Zijderveld authored 10 months ago
  
  1321ab08
- adjust mexican hat file to work with latest refactor · fb0e0fa1
  Johanna Zijderveld authored 10 months ago
  
  ' :wq :
  fb0e0fa1
- apply RUFF rules for docstrings · 8f586d38
  Johanna Zijderveld authored 10 months ago
  
  8f586d38
- apply RUFF rules F, E, W, N and I · 1db16b76
  Johanna Zijderveld authored 10 months ago
  
  1db16b76
- rm commented out old code · 25a30ca7
  Kostas Vilkelis authored 10 months ago
  
  25a30ca7
Apr 30, 2024
- remove old example files · da9922cc
  Kostas Vilkelis authored 10 months ago
  
  da9922cc
- bundle kwant functions together · da5aac2d
  Kostas Vilkelis authored 10 months ago
  
  da5aac2d
- remove outdated readme · 0e9e296f
  Kostas Vilkelis authored 10 months ago
  
  0e9e296f
- compare against singleshot diagonalization · e76fec90
  Kostas Vilkelis authored 10 months ago
  
  e76fec90
- remove redundant kfuncs · 227060ba
  Kostas Vilkelis authored 10 months ago
  
  227060ba
- Bundle density matrix and fermi energy calc · b4127776
  Kostas Vilkelis authored 10 months ago
  
  b4127776
- move tests to dedicated folder · 67fc8a89
  Kostas Vilkelis authored 10 months ago
  
  67fc8a89
- increase range of the test · d96f491f
  Kostas Vilkelis authored 10 months ago
  
  d96f491f
- include fermi shift after solver finds solution · 7dfd1c33
  Kostas Vilkelis authored 10 months ago
  
  7dfd1c33
- fix docstring · 9929cdef
  Kostas Vilkelis authored 10 months ago
  
  9929cdef
- test tb khamvecs · d5ddbf6f
  Kostas Vilkelis authored 10 months ago
  
  d5ddbf6f
- fix docstring · 7f527979
  Kostas Vilkelis authored 10 months ago
  
  7f527979
- avoid computing density matrix in solver · fd0eeb5c
  Kostas Vilkelis authored 10 months ago
  
  fd0eeb5c
- move rho outside Model · 1c819722
  Kostas Vilkelis authored 10 months ago
  
  1c819722
- remove ndim from func arguments · 3afebd6f
  Kostas Vilkelis authored 10 months ago
  
  3afebd6f
- fix typo and pipeline · f70438d3
  Antonio Manesco authored 10 months ago
  
  f70438d3
- allow zero-dimensional systems: · 4aa6e00d
  Antonio Manesco authored 10 months ago
  
  4aa6e00d
- fix expectation value calculation · 84423c33
  Antonio Manesco authored 10 months ago
  
  84423c33
- confirm that energy calculation is the issue with Antonio and Kostas · 424b2833
  Johanna Zijderveld authored 10 months ago
  
  424b2833
Apr 24, 2024
- tiny refactor done during meeting and relevant adjustment in mexican_hat example file · fd4701fd
  Johanna Zijderveld authored 10 months ago
  
  fd4701fd
Apr 22, 2024
- try to translate tEnergyTest.ipynb to the refactored code · c7c0707a
  Johanna Zijderveld authored 10 months ago
  
  c7c0707a
Apr 16, 2024
- adjust tolerance of 1d hubbard test? (not sure if reasonable) · 8af36681
  Johanna Zijderveld authored 11 months ago
  
  8af36681
- Fix bug in transpose of kgrid density matrix · c3498546
  Johanna Zijderveld authored 11 months ago
  
  c3498546
- make zero_hint into test by fixing substraction of fermi energy · b007394c
  Johanna Zijderveld authored 11 months ago
  
  b007394c
- add calculation of fermi energy function outside model class · 0ceeda9b
  Johanna Zijderveld authored 11 months ago
  
  0ceeda9b