INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --params=10.4152,1.6357247,0.31830311,0.81966704,0.46519346,0.20236843,0.54218647,0.36473096,0.87644393,0.86132444,0.33059886,0.28059813,0.064561489 --webpage INFO:kim_tools.test_driver.core:The configuration you provided has a maximum force component 0.34968453996586313 eV/angstrom. Unless the Test Driver you are running provides minimization, you may wish to relax the configuration. INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --params=10.4152,1.6357247,0.31830311,0.81966704,0.46519346,0.20236843,0.54218647,0.36473096,0.87644393,0.86132444,0.33059886,0.28059813,0.064561489 --webpage INFO:kim_tools.test_driver.core:Minimization converged after 28 steps. INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:Attempting to find NN distance by searching within covalent radii times 1 INFO:kim_tools.aflow_util.core:Attempting to find NN distance by searching within covalent radii times 2 INFO:kim_tools.aflow_util.core:Automatically set max fractional residual for solving position equations to 0.0019945066490285857 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmpp9v39c7r | aflow --np=4 --compare2prototypes --catalog=anrl --quiet --print=json INFO:kim_tools.aflow_util.core:Detected encyclopedia entry None: None INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --params=10.1914,1.6372334,0.31842941,0.31971372,0.53357747,0.79678109,0.87596658,0.36086173,0.45764965,0.13484372,0.28031364,0.95033838,0.064751188 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-1.01914e+01 2.43641e-07 -1.66857e+01] (Cartesian), [-0.99999603 -0.999996 -0.99999879] (fractional) INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --equations_only INFO:kim_tools.aflow_util.core:Additionally shifting atoms by internal fractional translation [0.0, 0.0, 0.0] INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --params=10.191440580727752,1.6372288199826328,0.31843062075741235,0.8197149318450654,0.4664249193991129,0.2032212971419043,0.12403580765948978,0.3608629477319141,0.542352738252414,0.13484492995163677,0.950342343603436,0.2803176328906378,0.06475240065387577 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[ 2.33125054e-07 -9.99999767e-01 0.00000000e+00] [-9.99999534e-01 -2.33125054e-07 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 1.00000000e+00]] INFO:kim_tools.symmetry_util.core:Found matching rotation with point group op: [[0.0, -1.0, 0.0], [-1.0, 0.0, 0.0], [0.0, 0.0, 1.0]] INFO:kim_tools.aflow_util.core:Found set of parameters for prototype A_hP68_194_ef2h2kl that is unrotated INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --params=10.191440580727752,1.6372288199826328,0.31843062075741235,0.8197149318450654,0.4664249193991129,0.2032212971419043,0.12403580765948978,0.3608629477319141,0.542352738252414,0.13484492995163677,0.950342343603436,0.2803176328906378,0.06475240065387577 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --params=10.191440580727752,1.6372288199826328,0.31843062075741235,0.8197149318450654,0.4664249193991129,0.2032212971419043,0.12403580765948978,0.3608629477319141,0.542352738252414,0.13484492995163677,0.950342343603436,0.2803176328906378,0.06475240065387577 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --params=10.191440580727752,1.6372288199826328,0.31843062075741235,0.8197149318450654,0.4664249193991129,0.2032212971419043,0.12403580765948978,0.3608629477319141,0.542352738252414,0.13484492995163677,0.950342343603436,0.2803176328906378,0.06475240065387577 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --params=10.191440580727752,1.6372288199826328,0.31843062075741235,0.8197149318450654,0.4664249193991129,0.2032212971419043,0.12403580765948978,0.3608629477319141,0.542352738252414,0.13484492995163677,0.950342343603436,0.2803176328906378,0.06475240065387577 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --params=10.191440580727752,1.6372288199826328,0.31843062075741235,0.8197149318450654,0.4664249193991129,0.2032212971419043,0.12403580765948978,0.3608629477319141,0.542352738252414,0.13484492995163677,0.950342343603436,0.2803176328906378,0.06475240065387577 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --params=10.191440580727752,1.6372288199826328,0.31843062075741235,0.8197149318450654,0.4664249193991129,0.2032212971419043,0.12403580765948978,0.3608629477319141,0.542352738252414,0.13484492995163677,0.950342343603436,0.2803176328906378,0.06475240065387577 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --params=10.191440580727752,1.6372288199826328,0.31843062075741235,0.8197149318450654,0.4664249193991129,0.2032212971419043,0.12403580765948978,0.3608629477319141,0.542352738252414,0.13484492995163677,0.950342343603436,0.2803176328906378,0.06475240065387577 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --params=10.191440580727752,1.6372288199826328,0.31843062075741235,0.8197149318450654,0.4664249193991129,0.2032212971419043,0.12403580765948978,0.3608629477319141,0.542352738252414,0.13484492995163677,0.950342343603436,0.2803176328906378,0.06475240065387577 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmploq6c5db --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --params=10.191440580727752,1.6372288199826328,0.31843062075741235,0.8197149318450654,0.4664249193991129,0.2032212971419043,0.12403580765948978,0.3608629477319141,0.542352738252414,0.13484492995163677,0.950342343603436,0.2803176328906378,0.06475240065387577 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmp7o4rqwm2 --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP68_194_ef2h2kl --params=10.191440580727752,1.6372288199826328,0.31843062075741235,0.8197149318450654,0.4664249193991129,0.2032212971419043,0.12403580765948978,0.3608629477319141,0.542352738252414,0.13484492995163677,0.950342343603436,0.2803176328906378,0.06475240065387577 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpxe6atelr --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.test_driver.core:Deduplicated 3 Property Instances down to 3.