ecut 5 kptopt 3 tolvrs 1.0D-10 rfelfd 3 rfdir 1 1 1 nqpt 1 qpt 3*0 irdwfk 1 irdddk 1 prtden 0 prteig 0 prtwf 0 nstep 50 acell 3*5.43 angstrom rprim 0 1/2 1/2 1/2 0 1/2 1/2 1/2 0 occopt 1 nband 4 ngkpt 2 2 2 nshiftk 4 shiftk 3*1/2 1/2 0 0 0 1/2 0 0 0 1/2 # znucl 14 ntypat 1 typat 2*1 natom 2 xred 3*0 3*1/4 pp_dirpath "$ABI_PSPDIR" pseudos "PseudosTM_pwteter/14si.pspnc" #%% #%% [setup] #%% executable = abinit #%% test_chain = t81.abi, t82.abi, t83.abi, t84.abi #%% [files] #%% files_to_test = #%% t82.abo, tolnlines = 0, tolabs = 0.000e+00, tolrel = 0.000e+00, fld_options = -medium #%% [paral_info] #%% max_nprocs = 2 #%% [extra_info] #%% authors = Unknown #%% keywords = NC, DFPT, DDK #%% description = #%% Compute silicon electric field perturbation, using WFK and DDK files produced in previous test. #%%