{ "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" [ [ 0.6977917 0.2559248 0.8783031 ] [ 0.349385 0.3940236 2.698898 ] [ 1.248694 1.36901 2.090768 ] [ 0.3246804 2.316928 0.2892628 ] [ 2.775341 0.8800459 0.0497676 ] [ 2.033969 2.77175 0.0650166 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.977917e-11 2.559248e-11 8.783031e-11 ] [ 3.49385e-11 3.940236e-11 2.698898e-10 ] [ 1.248694e-10 1.36901e-10 2.090768e-10 ] [ 3.246804e-11 2.316928e-10 2.892628e-11 ] [ 2.775341e-10 8.800459e-11 4.976760000000001e-12 ] [ 2.033969e-10 2.77175e-10 6.50166e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.4276519 -38.1119405 -57.4107824 ] [ -62.337481 -58.2669469 71.1048353 ] [ 63.7743265 79.5657542 8.2078071 ] [ -40.5994762 2.6956361 -2.8458993 ] [ 12.1095416 -15.5116039 -6.5595337 ] [ 33.4807411 29.629101 -12.4964269 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.02982336008207e-08 -6.106206004242067e-08 -9.198221334311612e-08 ] [ -9.98756546577642e-08 -9.335394008857504e-08 1.139225047434946e-07 ] [ 1.021777349255659e-07 1.274783911955594e-07 1.315035664365625e-08 ] [ -6.504753158436603e-08 4.318885137604491e-09 -4.559633323611085e-09 ] [ 1.940162444012502e-08 -2.48523291196901e-08 -1.050953153748972e-08 ] [ 5.364206063747768e-08 4.74710529175219e-08 -2.002148302271622e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 56.730308 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.089197316838321e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5426259 0.1831359 0.4674935 ] [ 0.1146466 -0.3823875 2.9580223 ] [ 1.4585319 1.754312 2.3799394 ] [ 0.0528797 2.6592052 0.4887678 ] [ 2.9757943 0.8452807 0.5791598 ] [ 2.2853828 2.9281361 -0.8013668 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.426259e-11 1.831359e-11 4.674935e-11 ] [ 1.146466e-11 -3.823875e-11 2.9580223e-10 ] [ 1.4585319e-10 1.754312e-10 2.3799394e-10 ] [ 5.287970000000001e-12 2.6592052e-10 4.887678e-11 ] [ 2.9757943e-10 8.452807e-11 5.791598e-11 ] [ 2.2853828e-10 2.9281361e-10 -8.013668e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.77e-05 -1.06e-05 -4.9e-06 ] [ -7e-06 -1.29e-05 -1.7e-06 ] [ 2.57e-05 1.71e-05 1.3e-06 ] [ 5e-07 8.4e-06 -1.57e-05 ] [ 1.36e-05 -6e-07 9.2e-06 ] [ -1.51e-05 -1.4e-06 1.17e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.835852618816e-14 -1.698307218048e-14 -7.850665441919999e-15 ] [ -1.12152363456e-14 -2.066807840832e-14 -2.72370025536e-15 ] [ 4.117593915456e-14 2.739722021568e-14 2.08282960704e-15 ] [ 8.010883104e-16 1.345828361472e-14 -2.515417294656e-14 ] [ 2.178960204288e-14 -9.6130597248e-16 1.474002491136e-14 ] [ -2.419286697408e-14 -2.24304726912e-15 1.874546646336e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.772469 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.527028108409276e-18 } }