Commits

Breadcrumbs

History for

on02537c8

User selector

All users

Datepicker

All time

Commit History

Commits on Oct 15, 2022

• Allowing for fixed Fermi level (JuliaMolSim#727)

  Show description for f68c8ac
  

  3 peopleauthored
  f68c8ac

Commits on Mar 14, 2022

• Change default kshift to zero (JuliaMolSim#630)

  mfherbst

  authored
  b41ba8d

Commits on Mar 11, 2022

• Excise symops, part 2 (JuliaMolSim#624)

  Show description for 5ce6af2
  

  antoine-levitt

  and

  mfherbst

  authored
  5ce6af2

• Make atoms and positions positional arguments of the Model (JuliaMolSim#629)

  mfherbst

  authored
  d36d7a5

Commits on Mar 10, 2022

• Refactor atoms field in Model (JuliaMolSim#626)

  mfherbst

  authored
  157dac8

Commits on Feb 21, 2022

• Use symmetrization in density construction (JuliaMolSim#589)

  Show description for 6134a14
  

  antoine-levitt

  and

  mfherbst

  authored
  6134a14

Commits on Dec 6, 2021

• Remove model backreference from Kpoint structure (JuliaMolSim#552)

  mfherbst

  authored
  9fd77d2

Commits on Nov 4, 2020

• MPI for distribution over k-Points (JuliaMolSim#347)

  Show description for a7a237f
  

  antoine-levitt

  and

  mfherbst

  authored
  a7a237f

Commits on Mar 29, 2020

• Implement index_G_vectors for k-Points

  mfherbst

  committed
  e1d6cea

Commits on Jan 29, 2020

• compute n_electrons from atoms if not provided

  

  antoine-levitt

  authored and

  mfherbst

  committed
  a4aa66e

Commits on Jan 25, 2020

• kpt.basis -> G_vectors(kpt)

  

  antoine-levitt

  authored and

  mfherbst

  committed
  81cf8ab

Commits on Dec 12, 2019

• RealFourierArray (JuliaMolSim#79)

  Show description for dda9544
  

  antoine-levitt

  authored and

  mfherbst

  committed
  dda9544

Commits on Nov 13, 2019

• Move determine_grid_size to PWBasis, use it in constructor

  antoine-levitt

  committed
  b63b540

Commits on Nov 5, 2019

• Renaming (JuliaMolSim#51)

  Show description for ed3d7f4
  

  antoine-levitt

  authored and

  mfherbst

  committed
  ed3d7f4

Commits on Oct 23, 2019

• New PlaneWaveModel and fourier transforms

  mfherbst

  committed
  a172d09

Commits on Aug 4, 2019

• A hacked working k-Point mapping for density

  mfherbst

  committed
  c46cffb

Commits on Jul 15, 2019

• Restructure tests

  mfherbst

  committed
  84c28bc

Loading