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Commits on Jul 5, 2021

• Remove starring (JuliaMolSim#469)

  mfherbst

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• A few more tweaks for potential mixing (JuliaMolSim#464)

  mfherbst

  authored
  3a9ef6f

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• Fermi-Dirac stability improvement (JuliaMolSim#465)

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  antoine-levitt

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Commits on Jun 29, 2021

• Workaround reorganization (JuliaMolSim#463)

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  antoine-levitt

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  mfherbst

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• Bump version: 0.3.3 → 0.3.4

  mfherbst

  committed
  94cada6

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• Small minor fixes in docs and dependencies (JuliaMolSim#462)

  mfherbst

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  6ec95f4

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Commits on Jun 28, 2021

• Potential mixing (JuliaMolSim#450)

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  mfherbst

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  antoine-levitt

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• interpolation from a basis to a smaller basis (JuliaMolSim#447)

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  gkemlin

  and

  mfherbst

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Commits on Jun 24, 2021

• Remove BlockArrays workaround (JuliaMolSim#458)

  antoine-levitt

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  7a74ea5

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Commits on Jun 21, 2021

• Bump version: 0.3.2 → 0.3.3

  mfherbst

  committed
  0476563

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Commits on Jun 20, 2021

• Workround for timing regression (JuliaMolSim#457)

  mfherbst

  authored
  a8c42c3

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• Prioritise DFTK-related packages in Binder Manifest (JuliaMolSim#451)

  mfherbst

  authored
  0357572

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• Bump version: 0.3.1 → 0.3.2

  mfherbst

  committed
  dea46dc

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• Undo performance workaround for newer version of BlockArrays (JuliaMolSim#454)

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  github-actions[bot]

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  mfherbst

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Commits on Jun 18, 2021

• Performance workaround for BlockArrays (JuliaMolSim#453)

  antoine-levitt

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  baebead

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Commits on Jun 16, 2021

• Fix binder setup (JuliaMolSim#449)

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  mfherbst

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Commits on Jun 8, 2021

• Bump version: 0.3.0 → 0.3.1

  mfherbst

  committed
  876f956

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• Use BlockArrays in LOBPCG (JuliaMolSim#442)

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  antoine-levitt

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  mfherbst

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  7d7a473

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• Non-allocating dot in kinetic (JuliaMolSim#440)

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  antoine-levitt

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  mfherbst

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Commits on Jun 3, 2021

• Bail out if magnetisation is too large (JuliaMolSim#439)

  mfherbst

  authored
  dae100d

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• Bump version: 0.2.8 → 0.3.0

  mfherbst

  committed
  d6c228f

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• Extra forces test for magnetic ground state (JuliaMolSim#437)

  mfherbst

  authored
  1e56a6b

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Commits on Jun 1, 2021

• Add RWTH Aachen funding (JuliaMolSim#435)

  mfherbst

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Commits on May 25, 2021

• CompatHelper: bump compat for "MPI" to "0.18" (JuliaMolSim#432)

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Commits on May 12, 2021

• Update publication list

  mfherbst

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Commits on May 11, 2021

• Update CITATION.bib

  mfherbst

  committed
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Commits on Apr 30, 2021

• Nowarn (JuliaMolSim#430)

  mfherbst

  authored
  ba66ced

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• Remove remaining from_fourier (JuliaMolSim#427)

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  gkemlin

  and

  mfherbst

  authored
  9eb74eb

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• Refactor damping out of mixing datastructures (JuliaMolSim#426)

  mfherbst

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  d5083c7

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Commits on Apr 29, 2021

• Merge pull request JuliaMolSim#413 from JuliaMolSim/refactor_densities

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  mfherbst

  authored
  fc9ccc9

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• Small cleanup pass

  mfherbst

  committed
  9e970d0

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Commits on Apr 28, 2021

• Eliminate dead code

  mfherbst

  committed
  ad7d61d

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• Update save_scfres docs

  mfherbst

  committed
  2e38f36

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• Remove coveralls badges

  mfherbst

  committed
  7447979

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• Rebase GGA collinear kernel functions

  mfherbst

  committed
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