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antoine-levitt

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Commits on Nov 8, 2022

• Update data_structures.md

  antoine-levitt

  authored
  d770b7a

Commits on Oct 25, 2022

• Fixup for chi0: use n==m rather than εn == εm

  antoine-levitt

  committed
  c799f8a

Commits on Oct 24, 2022

• Require Interpolations 1.14 (JuliaMolSim#768)

  antoine-levitt

  authored
  5f24d3d

• Update Brillouin to 0.5.10 (JuliaMolSim#769)

  antoine-levitt

  authored
  07afb0e

Commits on Oct 17, 2022

• Optimize symmetry checking (JuliaMolSim#751)

  Show description for 8eb5e1e
  

  antoine-levitt

  and

  mfherbst

  authored
  8eb5e1e

Commits on Oct 5, 2022

• Fix forces with symmetries (JuliaMolSim#744)

  antoine-levitt

  authored
  353c11f

Commits on Aug 30, 2022

• typo

  antoine-levitt

  committed
  8cf0d82

Commits on Jul 25, 2022

• minor doc fix

  antoine-levitt

  committed
  558bde3

• minor corrections in docs

  antoine-levitt

  committed
  3a14c3c

• Overhaul docs organisation (JuliaMolSim#684)

  Show description for f7fcc31
  

  antoine-levitt

  and

  mfherbst

  authored
  f7fcc31

Commits on Jul 18, 2022

• Add code for paper by Cazalis on 2D-confined graphene (JuliaMolSim#689)

  antoine-levitt

  authored
  001605a

Commits on Jul 12, 2022

• Graphene band structure (JuliaMolSim#683)

  Show description for a2191e4
  

  antoine-levitt

  and

  mfherbst

  authored
  a2191e4

Commits on Jul 7, 2022

• Store G_vectors and r_vectors in the basis (JuliaMolSim#680)

  Show description for d962dc2
  

  antoine-levitt

  and

  mfherbst

  authored
  d962dc2

Commits on Jun 25, 2022

• Performance optimizations (JuliaMolSim#671)

  Show description for f06b277
  

  antoine-levitt

  and

  mfherbst

  authored
  f06b277

Commits on Jun 21, 2022

• Fix performance gotcha (JuliaMolSim#665)

  Show description for 7f848ae
  

  antoine-levitt

  and

  mfherbst

  authored
  7f848ae

Commits on Jun 16, 2022

• Turn warning to error (JuliaMolSim#667)

  Show description for 4e8b4ba
  

  antoine-levitt

  and

  mfherbst

  authored
  4e8b4ba

Commits on May 13, 2022

• Filter rgrid symmetries (JuliaMolSim#642)

  antoine-levitt

  authored
  58bf881

Commits on Apr 12, 2022

• Test consistency of local potential in both real and Fourier space (JuliaMolSim#647)

  antoine-levitt

  authored
  e77e6a0

Commits on Apr 7, 2022

• Simplify pwbasis constructors (JuliaMolSim#640)

  antoine-levitt

  authored
  d3966a8

Commits on Mar 11, 2022

• Excise symops, part 2 (JuliaMolSim#624)

  Show description for 5ce6af2
  

  antoine-levitt

  and

  mfherbst

  authored
  5ce6af2

Commits on Mar 10, 2022

• Excise ksymops (JuliaMolSim#622)

  Show description for 5331193
  

  antoine-levitt

  and

  mfherbst

  authored
  5331193

Commits on Mar 5, 2022

• Symop refactoring (again!) (JuliaMolSim#619)

  antoine-levitt

  authored
  a836375

Commits on Mar 4, 2022

• Refactoring diagonalize_all_kblocks (JuliaMolSim#617)

  antoine-levitt

  authored
  2f8aeef

• Small optimizations (JuliaMolSim#615)

  antoine-levitt

  authored
  09bd6a6

Commits on Mar 2, 2022

• Fix performance issue in block array (JuliaMolSim#611)

  antoine-levitt

  authored
  725f2a1

Commits on Mar 1, 2022

• Random optimization (JuliaMolSim#610)

  antoine-levitt

  authored
  e8001dd

• Random optimization

  antoine-levitt

  committed
  327d15b

Commits on Feb 28, 2022

• Change printing (JuliaMolSim#606)

  Show description for dc103ba
  

  antoine-levitt

  and

  mfherbst

  authored
  dc103ba

• Fix unsafe use of unpack (JuliaMolSim#608)

  antoine-levitt

  authored
  87ab504

• Switch maximum iteration count to 100 (JuliaMolSim#607)

  antoine-levitt

  authored
  68a3eb5

Commits on Feb 25, 2022

• Use Val(true) in G_to_r to help const-prop (JuliaMolSim#605)

  antoine-levitt

  authored
  8eadc55

Commits on Feb 24, 2022

• Fix stress symmetrization (JuliaMolSim#603)

  Show description for 151f2a0
  

  antoine-levitt

  and

  mfherbst

  authored
  151f2a0

Commits on Feb 23, 2022

• Symmetrize forces (JuliaMolSim#596)

  Show description for 610bac4
  

  antoine-levitt

  and

  mfherbst

  authored
  610bac4

Commits on Feb 21, 2022

• Fix threading (JuliaMolSim#592)

  Show description for f8c2e6b
  

  antoine-levitt

  and

  mfherbst

  authored
  f8c2e6b

• Use symmetrization in density construction (JuliaMolSim#589)

  Show description for 6134a14
  

  antoine-levitt

  and

  mfherbst

  authored
  6134a14

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