{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.047673 1.456203 2.59416 ] [ 0.648425 2.408552 0.8864435 ] [ 2.028254 0.9559849 0.3097335 ] [ 1.556479 0.0798405 1.221415 ] [ 2.621496 2.506538 1.825694 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.047673e-10 1.456203e-10 2.59416e-10 ] [ 6.48425e-11 2.408552e-10 8.864435000000001e-11 ] [ 2.028254e-10 9.559849e-11 3.097335e-11 ] [ 1.556479e-10 7.98405e-12 1.221415e-10 ] [ 2.621496e-10 2.506538e-10 1.825694e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.857471 -5.4379588 17.6160701 ] [ -11.060217 10.6190196 -9.869883 ] [ 26.3548927 34.8033324 -57.6261835 ] [ -23.153474 -53.1904168 43.923161 ] [ 14.7162693 13.2060236 5.9568354 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.0986879714014e-08 -8.712570454233624e-09 2.822405566459392e-08 ] [ -1.772042109837471e-08 1.701354493893697e-08 -1.581329579263136e-08 ] [ 4.222519292763259e-08 5.576108549721116e-08 -9.232732394963072e-08 ] [ -3.709595473310066e-08 -8.522044224756755e-08 7.037266166583435e-08 ] [ 2.357806261785679e-08 2.115838226565305e-08 9.543902411833816e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 20.202099 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.236733070888706e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7307569 1.0591148 2.9700082 ] [ 0.8162584 2.9756631 -0.1761112 ] [ 1.3826387 0.8461647 -0.1637916 ] [ 1.4841558 -0.5830161 1.5098874 ] [ 2.4885173 3.1091918 2.6974531 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7307569e-10 1.0591148e-10 2.9700082e-10 ] [ 8.162584000000001e-11 2.9756631e-10 -1.761112e-11 ] [ 1.3826387e-10 8.461647e-11 -1.637916e-11 ] [ 1.4841558e-10 -5.830161000000001e-11 1.5098874e-10 ] [ 2.4885173e-10 3.1091918e-10 2.6974531e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.2172961 -0.1795408 -0.1010193 ] [ 0.132939 -0.3297497 -0.2685018 ] [ -0.3151959 0.5616826 -0.516489 ] [ 0.0729304 0.0851538 0.6016436 ] [ -0.1079695 -0.1375458 0.2843665 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.481467312110189e-10 -2.876560722397287e-10 -1.618507607095814e-10 ] [ 2.129917577925312e-10 -5.283172600558138e-10 -4.301873066027175e-10 ] [ -5.049995019520147e-10 8.999147300301582e-10 -8.275066007003712e-10 ] [ 1.168473818255923e-10 1.364314275322791e-10 9.639393099739468e-10 ] [ -1.729862086594656e-10 -2.203726650492326e-10 4.556053580387232e-10 ] ] } "relaxed-potential-energy" { "source-value" -10.031904 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.607288205091001e-18 } }