# anaddb analysis of Au zigzag wire ifcflag 0 brav 1 ngqpt 1 1 11 nqshft 1 q1shft 3*0.0 asr 3 chneut 0 eivec 4 nph1l 11 qph1l 0.0 0.0 0.0 1.0 0.0 0.0 0.05 1.0 0.0 0.0 0.1 1.0 0.0 0.0 0.15 1.0 0.0 0.0 0.2 1.0 0.0 0.0 0.25 1.0 0.0 0.0 0.3 1.0 0.0 0.0 0.35 1.0 0.0 0.0 0.4 1.0 0.0 0.0 0.45 1.0 0.0 0.0 0.5 1.0 #%% #%% [setup] #%% executable = anaddb #%% input_ddb = t83.ddb.out #%% test_chain = t81.in, t82.in, t83.in, t84.in #%% [files] #%% files_to_test = #%% t83.out, tolnlines = 0, tolabs = 0.000e+00, tolrel = 0.000e+00 #%% extra_inputs = t83.ddb.out.gz #%% [paral_info] #%% max_nprocs = 4 #%% [extra_info] #%% authors = Unknown #%% keywords = #%% description = Tests asr=3, 1D - rotational invariance for anaddb. This algorithm has never been finalized. #%%