{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8418467 2.762205 0.4902926 ] [ 2.44915 0.8560816 2.901808 ] [ 2.702124 1.919715 0.4432873 ] [ 2.179656 2.770411 2.292824 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.418467e-11 2.762205e-10 4.902926e-11 ] [ 2.44915e-10 8.560816e-11 2.901808e-10 ] [ 2.702124e-10 1.919715e-10 4.432873e-11 ] [ 2.179656e-10 2.770411e-10 2.292824e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.5412832 2.9789137 -3.7760895 ] [ 0.7984415 -4.4883498 2.525414 ] [ 7.0545843 -4.3349929 -5.5463968 ] [ 0.6882575 5.8444291 6.7970723 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.368464425467181e-08 4.772745885520825e-09 -6.049962314948361e-09 ] [ 1.279244304376483e-09 -7.191129115532355e-09 4.046159268641011e-09 ] [ 1.130269003492273e-08 -6.945424275713991e-09 -8.886307282639934e-09 ] [ 1.102710075590256e-09 9.363807665943186e-09 1.089011032894728e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.533807 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.661782957819386e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.383815 2.8256296 -0.7619785 ] [ 2.5847841 0.6273187 4.017536 ] [ 2.2055882 2.7929712 0.4768233 ] [ 2.9985895 2.062493 2.3958312 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.83815e-11 2.8256296e-10 -7.619785e-11 ] [ 2.5847841e-10 6.273187e-11 4.017536e-10 ] [ 2.2055882e-10 2.792971200000001e-10 4.768233e-11 ] [ 2.9985895e-10 2.062493e-10 2.3958312e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.4076872 0.0643 0.1392836 ] [ 0.2342222 0.4599219 -0.4089769 ] [ -0.4582519 0.001669 -0.2103252 ] [ -0.1836575 -0.5258908 0.4800185 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.531869004394139e-10 1.0301995671744e-10 2.231569275808589e-10 ] [ 3.752653329123418e-10 7.368761155739155e-10 -6.552532276272594e-10 ] [ -7.342004806171795e-10 2.6740327801152e-12 -3.369781182050842e-10 ] [ -2.94251752734576e-10 -8.425699448538086e-10 7.690744182514848e-10 ] ] } "relaxed-potential-energy" { "source-value" -8.3121969 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.331760754066624e-18 } }