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v0.5.0

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@pablosanjose pablosanjose released this 14 May 18:00
· 978 commits to master since this release
6118d1a

This release includes PR from #110 to #161. The highlights are:

  • Wavefunction, currents, density plotting with VegaLite and other vlplot enhancements: #110, #111, #116, #126, #128, #138, #139, #140, #141, #152
  • Unflatten to restore orbital structure in matrices, vectors, subspaces...: #112, #161, #147
  • Can do algebra with Hamiltonians (sum, linear combinations...): #113
  • Can do boolean combinations of RegionPresets: #129
  • Fixes to unitcell: #117 (still needs some more)
  • Much better handling of degeneracies in bandstructures, including topological defects as Dirac points: #124, #119, #125, #127, #145
  • Dangling bond removal with mincoordination: #131, #133
  • Remove invalidations for faster compilation: #132
  • Indexing into bandstructure gives interpolated eigenpairs: #134
  • Add Hexagonal Closed Packing lattice preset: #157
  • Implement the deflated Schur algorithm for quasi1D Green functions: #161