Commits

Branch selector

 develop

User selector

All users

Datepicker

All time

Commit History

Commits on Aug 19, 2024

• Add <write_denvis_input> and <no_core_density> inputs to kkrparams.

  PhilippRue

  committedAug 19, 2024
  5344721

Commits on Aug 1, 2024

• Add freeze_ldau input option

  PhilippRue

  committedAug 1, 2024
  da52a9f

Commits on Jul 31, 2024

• Add KKR inputs for grid coarsening

  PhilippRue

  committedJul 31, 2024
  f4f60ec

Commits on Jul 30, 2024

• Merge branch 'develop' of https://github.com/JuDFTteam/masci-tools into develop

  dantogni

  committedJul 30, 2024
  4b6f8ff

• Adding NACLSD param in kkrhost json inputs + fix json file names

  dantogni

  committedJul 30, 2024
  b6af98e

• Adding NACLSD param in kkrhost json inputs + fix json file names

  dantogni

  committedJul 30, 2024
  25ac225

Commits on Jul 5, 2024

• This version of the parser now it is able to work with the changes in the imp parser in the dos mode. It doesn't try to access the convergence data now if it sees that the doscalc mode is True

  Raff-physics

  committedJul 5, 2024
  063511c

Commits on Jul 4, 2024

• parser for impurity calculation is now able to tell if it is in dos calculation mode

  Raff-physics

  committedJul 4, 2024
  ba3aa7f

Commits on May 28, 2024

• Add inp.xml Schema V 0.38

  d-wortmann

  committedMay 28, 2024
  ce09419

Commits on May 3, 2024

• Minor formatting improvement to kkrparams

  PhilippRue

  committedMay 3, 2024
  f8502e6

Commits on Mar 27, 2024

• Minor formatting improvements

  PhilippRue

  committedMar 27, 2024
  604543a

• Fix tests for kkrimp tools

  PhilippRue

  committedMar 27, 2024
  8bffa49

• Merge branch 'update_kkrparams' into develop

  PhilippRue

  committedMar 27, 2024
  48c4720

• Update test to last commit

  PhilippRue

  committedMar 27, 2024
  f0707ec

• Move kkrparam defaults out of kkr_params file and into json files

  PhilippRue

  committedMar 27, 2024
  66a6759

Commits on Mar 14, 2024

• Adding LDAU pot rms parsing for impurity calculations

  dantogni

  committedMar 14, 2024
  b33ba54

Commits on Feb 6, 2024

• Merge branch 'develop' of https://github.com/JuDFTteam/masci-tools into develop

  dantogni

  committedFeb 6, 2024
  6c3b931

• Fixing EF_SET input in kkr_params.py

  dantogni

  committedFeb 6, 2024
  b250fe0

Commits on Dec 21, 2023

• Fix case sensitivity

  MRHemmati

  committedDec 21, 2023
  ee336f0

Commits on Nov 22, 2023

• Fixing pre-commit errors

  dantogni

  committedNov 22, 2023
  b339413

• Adding MIXLDAU_STEP and MIXFAC_LDAU inputs to kkr_params.py

  dantogni

  committedNov 22, 2023
  071ac32

• Add control parameters for spin mixing of imp code to kkrparams

  PhilippRue

  committedNov 22, 2023
  d77c190

• Add LATTICE_RELAX input in kkrparams for imp code

  PhilippRue

  committedNov 22, 2023
  8bf418c

Commits on Oct 31, 2023

• Improve pylint score

  PhilippRue

  committedOct 31, 2023
  a2a4c4a

• Minor update to kkrimp parser

  PhilippRue

  committedOct 31, 2023
  23203eb

Commits on Oct 3, 2023

• Update README.md

  Irratzo

  committedOct 3, 2023
  e29e5a7

• Update README.md

  Irratzo

  committedOct 3, 2023
  6fcbaa4

• Update README.md

  Irratzo

  committedOct 3, 2023
  4b45b74

Commits on Aug 28, 2023

• Add input values for tolerances of Voronoi code to kkrparams class

  PhilippRue

  committedAug 28, 2023
  eb2417c

Commits on Jun 27, 2023

• Add MIXLDAU to kkrparams

  PhilippRue

  committedJun 27, 2023
  3f0d612

Commits on Jun 7, 2023

• Add formatting for BdG_triplet_dvec

  PhilippRue

  committedJun 7, 2023
  0014692

• Add BdG triplet d-vector input

  PhilippRue

  committedJun 7, 2023
  9444db8

Commits on Jun 2, 2023

• Fix writeout of triplet parameters

  PhilippRue

  committedJun 2, 2023
  c726b7c

• Update tests

  PhilippRue

  committedJun 2, 2023
  06af26c

• Add inputs for BdG triplet pairing

  PhilippRue

  committedJun 2, 2023
  61e2cc0

Pagination

PreviousNext