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  • BdG
  • BdG-Akai
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  • BdG_adaptive_integration
  • BdG_constraining
  • KKRIMP-BdG
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Created with Raphaël 2.2.01Aug31Jul302926241917151110924Jun193May27Mar16Feb5Dec24Nov211631Oct1118Sep25Jul21181230Jun2928151497652131May301716151098543227Apr26252416151410Mar1Feb31Jan2524232019181716Dec1587529Nov23211716151484227Oct26251022Sep1217Aug228Jul27262521854130Jun21712May9526Apr85329Mar23221148Feb331Jan252110Dec62128Nov171615108543128Oct27262522211918141187654330Sep2823109818Aug10954321Jul121128May251811765428Apr26211914128129Mar261715121110943226Feb2523221931Jan27262521201918151318Dec1711843130Nov27261817161312109654330Oct282723222120Minor improvements to memory footprintAdd verbose writeout modeAdd input to control number iterations before k-grid is updatedMake grid coarsening work for 2D k-point gridsAdd coarsening functionalityAdd rho2ns.dat writeout modeVersion with problem with different phases (19.07.2024)BdG_constrainingBdG_constrainingMerge branch 'BdG' into coarsen-k-intImprove SOC symmetry check for nonco anglesSmall improvements for bandstructure calculation with advanced options (LDA+U, Lloyd)Small bugfixFix computation of L-operator for Pkkprime and some refactoringAllow to read in kpoints without integration weight and some refactoringAdd 'read_kpoints' optionAdd missing CPP_NONPY preprocessor flagsSmall bugfixAdd <coarsen_kpts> option and implement writeout of k-integrandAdd 'write_rho_dat' input to be able to write out the density to theincrease dimensions to be prepared for higher lmaxprovide output of Ewald parametersMerge branch 'BdG' into KKRIMP-BdGMerge branch 'KKRIMP-BdG' into BdGAdd writeout of rho.dat filecorrected values for Etot in regtestsAdd dvec alaysis to transform gflle tool and bugfix qdos reorderingMerge branch 'BdG' into BdG_triplet_pairingunnecessary allocates removedRemove link to old wiki pagemastermasterChange reordering of qdos filesRemove wrong deactivation of k-point loopAdd KEEP_EPARA_1B runoption to deactivate switching to k-point parallelism in main1bSmall fix LDAU inputsSome refactoring for readabilitytest_utrafotest_utrafoMinor refactoringRemove compiler complaint about mkl vs qmkl flagFix typoFix u-trafo with BdG and refactor some filesBugfix opening file in first iterationAdd reading of shift positions and prepare support of SOCAdd reading of impurity shift vectors