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  • BdG
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Created with Raphaël 2.2.014Nov14Oct16Sep28Aug272622191698131Jul302926241917151110924Jun193May27Mar16Feb5Dec24Nov211631Oct1118Sep25Jul21181230Jun2928151497652131May301716151098543227Apr26252416151410Mar1Feb31Jan2524232019181716Dec1587529Nov23211716151484227Oct26251022Sep1217Aug228Jul27262521854130Jun21712May9526Apr85329Mar23221148Feb331Jan252110Dec62128Nov171615108543128Oct27262522211918141187654330Sep2823109818Aug10954321Jul121128May251811765428Apr26211914128129Mar261715121110943226Feb2523221931Jan27262521201918151318Dec1711843130Nov27261817161312109654330Oct2827Add forgotten fileReactivate MPI for deci-out step (if only k-loop is parallelized, thisAdd NPOI input for voronoi to contol number of radial points for shapefunAdd test option 'cut_rho2ns_rmt' to cut everything at the muffin-tin radius before writing out the rho.dat fileMerge branch 'BdG_triplet_pairing' into BdGexpress NonCollinearMagnetism_mod.F90 in terms of several modulesSmall bugfix: move position of set up of GAUNT coefficientsSome refactoringRename cutting option introduced in last commitAdd option to cut non-spherical part for denvis inputFix no_madel optionmaybe fixes adaptive integration, needs testingMerge branch 'coarsen-k-int' into BdGPort qdos reordering fix from BdG_triplet branchDeactivate grid coarsening for qdos moderemove test density output for Z=22 and Z=28update description comments and referencesMinor 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 file