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  • BdG
  • BdG-Akai
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  • BdG_adaptive_integration
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  • KKRIMP-BdG
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  • kkrnano-dev2017
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Created with Raphaël 2.2.028Sep23109818Aug10954321Jul121128May251811765428Apr26211914128129Mar261715121110943226Feb2523221931Jan27262521201918151318Dec1711843130Nov27261817161312109654330Oct28272322212098762128Sep22211124Aug18764331Jul30292422212017161413876230Jun292523221815430May2726252098652130Apr292827242387631Mar2619910Feb16Jan13Dec1211109621Nov13128765424Oct23222118161510916Sep430Aug28272322191413729Jul2128Jun2719181713127654329May282724232221201715823Apr181715129822Mar19181411876527Feb262521191211531JanMerge branch 'kkrnano-activate-tests' into 'kkrnano-chebyshev-tfQMRgpu'Merge branch 'merge_improved_chebychev_solver' into 'develop'Merge branch 'develop' into merge_improved_chebychev_solverUpdate test files for new Chebychev solverActivate Lloyd testsWrite G_LL'(k,E) to npy filesupdate code activated by -D DEBUG macro in TYPE=debug Makefile optionPrepare KKRnano Makefile for tfQMRgpu libraryImplementation of tfQMRgpuPrepare merge into kkrnano-chebyshev-tfQMRgpu branchRemove verbose output of the testsReduce minimum number of ranks used in the testsMinor changeVerbose test run for KKRnanoTest: show files for Cu1 before runnig the testChange test run for KKRnano from srun to mpirunActivate KKRnano testsActivate test for constrining fieldsMerge branch 'develop' of iffgit.fz-juelich.de:kkr/jukkr into developRevised calculation of atomic orbital moment and added projection to local spin directionFixed typo in stop statementAdd constraining field test filesMerge branch 'develop' into nocoBfieldnocoBfieldnocoBfieldCorrected error in caling spinorbit_hamCorrected error in caling spinorbit_hamFirst version that runs bandstructure module from KKRhostChange bands.x interface with KKRhostActivate potential writeout with '<write_BdG_tests>= T' inputAdded switch for muffin-tin constraint and rms calculationSome cleanupMinor changescorrected error in dimension of excadded angles_cutoff to spinmix_broydenAdds in input possible specification of the a_log parameter of the exponential mesh. Removes hard-coded a_log.Add output forsum of x,y,z moments in unit cell in noncollinear modechanges in energyloop.f90 & storing efermi_in in read_potential.f90changes in energyloop.f90 & storing efermi_in read_potential.f90Skip rhocore calculation if density of states is calculatedNew parameter NVAC determining number of empty positions being optimized by centroidal tesselationMerge branch 'PartialNorm' into 'BdG'