{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.175063 2.090387 1.108777 ] [ 2.290473 2.943113 3.7458 ] [ 1.562387 4.346014 1.227002 ] [ 3.205072 1.346551 2.036178 ] [ 4.414518 1.768723 4.119804 ] [ 3.44377 3.554925 2.238453 ] [ 4.008705 3.851776 5.027783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.175063e-10 2.090387e-10 1.108777e-10 ] [ 2.290473e-10 2.943113e-10 3.7458e-10 ] [ 1.562387e-10 4.346014000000001e-10 1.227002e-10 ] [ 3.205072e-10 1.346551e-10 2.036178e-10 ] [ 4.414518e-10 1.768723e-10 4.119804e-10 ] [ 3.44377e-10 3.554925e-10 2.238453e-10 ] [ 4.008705e-10 3.851776e-10 5.027783000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3935912 -0.7886083 -1.1317069 ] [ -12.4417264 4.2326885 6.1309708 ] [ -0.7266269 1.4819551 -1.1998717 ] [ 2.3197554 -9.4396986 -6.0850264 ] [ 1.5124428 4.9031318 -9.0244821 ] [ 10.4361359 -3.8763795 10.9147445 ] [ 1.2936104 3.486911 0.395372 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.83495589198802e-09 -1.263489791638462e-09 -1.813194351716574e-09 ] [ -1.993384332470094e-08 6.781514613700508e-09 9.822898159496286e-09 ] [ -1.164184640815854e-09 2.374353833857133e-09 -1.922406401537858e-09 ] [ 3.716657898475323e-09 -1.512406452892251e-08 -9.749287115353138e-09 ] [ 2.423200514421535e-09 7.85568320338236e-09 -1.445881435457125e-08 ] [ 1.672053308822856e-08 -6.210644659416602e-09 1.748734860398001e-08 ] [ 2.072592356379393e-09 5.586647329037574e-09 6.334557801378479e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.595627 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.139565570797952e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3939793 2.1245976 0.4577014 ] [ 2.1727721 2.638086 4.2818692 ] [ 1.5442986 4.2497351 1.3384697 ] [ 2.7042974 1.2926237 2.242046 ] [ 4.5618263 1.8167012 3.8837623 ] [ 3.5735971 3.65547 2.4263132 ] [ 4.1492171 4.1242754 4.8736353 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3939793e-10 2.1245976e-10 4.577014e-11 ] [ 2.1727721e-10 2.638086e-10 4.2818692e-10 ] [ 1.5442986e-10 4.2497351e-10 1.3384697e-10 ] [ 2.7042974e-10 1.2926237e-10 2.242046e-10 ] [ 4.5618263e-10 1.8167012e-10 3.8837623e-10 ] [ 3.5735971e-10 3.65547e-10 2.4263132e-10 ] [ 4.149217100000001e-10 4.1242754e-10 4.873635300000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.36e-05 7.96e-05 -2.29e-05 ] [ -4.7e-05 -1.03e-05 -2.75e-05 ] [ -2.96e-05 -1.03e-05 -1.09e-05 ] [ 5.12e-05 -0.0001129 1.59e-05 ] [ -4.4e-06 -1.54e-05 -1.82e-05 ] [ 2.76e-05 -3.61e-05 -2.08e-05 ] [ 4.58e-05 0.0001054 8.43e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.985490124239999e-14 1.275332600664e-13 -3.66898449186e-14 ] [ -7.530230179799998e-14 -1.65024193302e-14 -4.4059857435e-14 ] [ -4.74244283664e-14 -1.65024193302e-14 -1.74637253106e-14 ] [ 8.20314436608e-14 -1.808857419786e-13 2.54746084806e-14 ] [ -7.0495771896e-15 -2.46735201636e-14 -2.915961473879999e-14 ] [ 4.42200750984e-14 -5.783857648740001e-14 -3.332527398719999e-14 ] [ 7.33796898372e-14 1.688694172236e-13 1.350634902462e-13 ] ] } "relaxed-potential-energy" { "source-value" -24.941647 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.99609240368762e-18 } }