{ "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" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7436972 -1.9617869 -2.1213514 ] [ 1.4943762 1.0533717 -0.1428803 ] [ -0.3580889 -0.4342699 -0.0360457 ] [ -2.0072357 -1.5260204 -2.087984 ] [ 0.8658369 2.3204649 2.1259828 ] [ -0.3730702 -0.7327138 0.5027776 ] [ 2.1218789 1.2809545 1.759501 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.793710887594422e-09 -3.143129106171707e-09 -3.398779617581349e-09 ] [ 2.394254610319945e-09 1.687687510752351e-09 -2.289194762328902e-10 ] [ -5.737216637479891e-10 -6.957770808971539e-10 -5.775157782037056e-11 ] [ -3.215946110975122e-09 -2.444954207743864e-09 -3.345319149404467e-09 ] [ 1.387223638605948e-09 3.71779461216701e-09 3.406199938382923e-09 ] [ -5.977243523571802e-10 -1.173936920097527e-09 8.055385161819342e-10 ] [ 3.399624765748821e-09 2.052315352208554e-09 2.819031366474221e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.429807 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.952780590125619e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1171666 2.5528215 1.6103089 ] [ 2.6903738 0.8330546 3.1565145 ] [ 2.4480165 3.0644076 3.9560604 ] [ 4.3381374 1.429272 1.542104 ] [ 4.6689616 1.940862 3.8878663 ] [ 4.1079012 3.7600833 1.0984542 ] [ 4.4302367 4.2585107 3.3838504 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1171666e-10 2.5528215e-10 1.6103089e-10 ] [ 2.6903738e-10 8.330546e-11 3.1565145e-10 ] [ 2.4480165e-10 3.0644076e-10 3.9560604e-10 ] [ 4.3381374e-10 1.429272e-10 1.542104e-10 ] [ 4.668961600000001e-10 1.940862e-10 3.8878663e-10 ] [ 4.1079012e-10 3.7600833e-10 1.0984542e-10 ] [ 4.4302367e-10 4.2585107e-10 3.3838504e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.3e-06 -5.9e-06 -1.49e-05 ] [ -2.3e-06 6.3e-06 3e-06 ] [ -4.11e-05 2.7e-06 2.79e-05 ] [ -5.7e-06 6.3e-06 4.5e-06 ] [ 2.73e-05 -3.2e-06 -2.66e-05 ] [ 1.3e-05 -1.6e-05 -6.9e-06 ] [ 7.6e-06 9.8e-06 1.28e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.08282960704e-15 -9.45284206272e-15 -2.387243164992e-14 ] [ -3.68500622784e-15 1.009371271104e-14 4.8065298624e-15 ] [ -6.584945911488e-14 4.32587687616e-15 4.470072772032e-14 ] [ -9.13240673856e-15 1.009371271104e-14 7.2097947936e-15 ] [ 4.373942174784e-14 -5.126965186560001e-15 -4.261789811328e-14 ] [ 2.08282960704e-14 -2.56348259328e-14 -1.105501868352e-14 ] [ 1.217654231808e-14 1.570133088384e-14 2.050786074624e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.43874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.434864800740979e-18 } }