{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.691051 2.220945 1.919277 ] [ 2.666072 2.808957 4.219459 ] [ 1.090931 4.286689 3.184511 ] [ 3.947256 1.730986 2.765408 ] [ 5.245402 2.932614 3.956238 ] [ 3.932067 4.011287 2.276365 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.691051e-10 2.220945e-10 1.919277e-10 ] [ 2.666072e-10 2.808957e-10 4.219459e-10 ] [ 1.090931e-10 4.286689e-10 3.184511e-10 ] [ 3.947256e-10 1.730986e-10 2.765408e-10 ] [ 5.245402000000001e-10 2.932614e-10 3.956238e-10 ] [ 3.932067e-10 4.011287e-10 2.276365e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.233116 -0.3527462 -1.1251499 ] [ -3.2592025 1.5262109 5.0870974 ] [ -0.87951 0.5195663 -0.2769836 ] [ -0.2882357 -8.5571783 -5.4674392 ] [ 5.6529244 2.4300911 4.4762105 ] [ 0.0071398 4.4340562 -2.6937353 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.975669642211544e-09 -5.651617193722908e-10 -1.802688879527437e-09 ] [ -5.221818090974384e-09 2.44525944253611e-09 8.150428589162152e-09 ] [ -1.40913037136934e-09 8.324369856738341e-10 -4.437766519212024e-10 ] [ -4.618045036246337e-10 -1.371011112523184e-08 -8.759803334055652e-09 ] [ 9.05698338744847e-09 3.893435178911356e-09 7.171679871965455e-09 ] [ 1.14392207314332e-11 7.10414123748283e-09 -4.31583975584098e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.3343387 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.495525935898193e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5404253 1.8389348 1.9013017 ] [ 2.9342033 4.2298295 4.3378149 ] [ 0.9227558 3.3824619 3.525243 ] [ 3.8686661 1.8946836 1.8809902 ] [ 4.6835767 2.3883902 4.2375621 ] [ 4.6231517 4.2571781 2.438346 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5404253e-10 1.8389348e-10 1.9013017e-10 ] [ 2.9342033e-10 4.2298295e-10 4.3378149e-10 ] [ 9.227558000000001e-11 3.3824619e-10 3.525243e-10 ] [ 3.8686661e-10 1.8946836e-10 1.8809902e-10 ] [ 4.6835767e-10 2.3883902e-10 4.2375621e-10 ] [ 4.623151700000001e-10 4.2571781e-10 2.438346e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.35e-05 1.2e-06 -1.21e-05 ] [ -3.1e-06 1.44e-05 2.6e-06 ] [ 3.2e-06 2.22e-05 2.74e-05 ] [ 1.6e-05 -1.87e-05 -2.03e-05 ] [ -1.35e-05 -1.4e-06 -3.1e-06 ] [ -3.61e-05 -1.77e-05 5.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.367291723899999e-14 1.9226119608e-15 -1.93863372714e-14 ] [ -4.9667475654e-15 2.30713435296e-14 4.165659248399999e-15 ] [ 5.1269652288e-15 3.55683212748e-14 4.389963977159999e-14 ] [ 2.5634826144e-14 -2.99607030558e-14 -3.252418567019999e-14 ] [ -2.162938455899999e-14 -2.2430472876e-15 -4.9667475654e-15 ] [ -5.783857648740001e-14 -2.83585264218e-14 8.6517538236e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.432427 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.312329731131072e-18 } }