{ "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" [ [ 0.6618616 0.5532969 2.6678 ] [ 1.355444 2.726321 1.335983 ] [ 0.8455628 2.30582 2.977156 ] [ 2.930365 0.9373095 0.4139469 ] [ 2.829062 1.427351 2.413715 ] [ 2.781652 2.87748 1.992398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.618616000000001e-11 5.532969e-11 2.6678e-10 ] [ 1.355444e-10 2.726321e-10 1.335983e-10 ] [ 8.455628e-11 2.30582e-10 2.977156e-10 ] [ 2.930365e-10 9.373095e-11 4.139469e-11 ] [ 2.829062e-10 1.427351e-10 2.413715e-10 ] [ 2.781652e-10 2.87748e-10 1.992398e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.2100833 -72.4443972 -11.3034902 ] [ -112.6191197 12.3186791 -110.9214299 ] [ -39.3643996 77.603793 67.5233421 ] [ 0.8244436 -7.6265523 -14.019877 ] [ 40.3117789 -216.8938802 63.15021 ] [ 108.6372135 207.0423576 5.5712449 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.540943793280513e-09 -1.16068719501789e-07 -1.811018773188192e-08 ] [ -1.804357206384167e-07 1.973669965315759e-08 -1.777157217314861e-07 ] [ -6.306872073094888e-08 1.243349828300027e-07 1.081843200709004e-07 ] [ 1.320904261088187e-09 -1.221908379236847e-08 -2.246231915589164e-08 ] [ 6.458658969643875e-08 -3.47502304051036e-07 1.011777900606104e-07 ] [ 1.740560036185581e-07 3.317184248620332e-07 8.926118327531234e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 107.56044 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.723308222909612e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.7452875 -0.0619413 3.4454171 ] [ 1.5227676 3.1355235 0.4735353 ] [ 0.5858436 2.4494476 2.8259533 ] [ 2.5712472 0.8922082 -0.0157551 ] [ 2.9136675 0.9131938 2.4749322 ] [ 3.0651339 3.4991466 2.5969161 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.452875e-11 -6.19413e-12 3.4454171e-10 ] [ 1.5227676e-10 3.1355235e-10 4.735353e-11 ] [ 5.858436e-11 2.4494476e-10 2.8259533e-10 ] [ 2.5712472e-10 8.922082e-11 -1.57551e-12 ] [ 2.9136675e-10 9.131938e-11 2.4749322e-10 ] [ 3.0651339e-10 3.4991466e-10 2.5969161e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.16e-05 5.98e-05 -2.36e-05 ] [ -5.98e-05 1.94e-05 -9.74e-05 ] [ -0.0001471 -1.43e-05 6.11e-05 ] [ 2.27e-05 1.91e-05 4.14e-05 ] [ 7.39e-05 -0.0001791 -1.19e-05 ] [ 9.87e-05 9.52e-05 3.04e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.858524880128e-14 9.581016192383999e-14 -3.781136825088e-14 ] [ -9.581016192383999e-14 3.108222644352e-14 -1.5605200286592e-13 ] [ -2.3568018091968e-13 -2.291112567744e-14 9.789299153088e-14 ] [ 3.636940929216e-14 3.060157345728e-14 6.633011210111999e-14 ] [ 1.1840085227712e-13 -2.8694983278528e-13 -1.906590178752e-14 ] [ 1.5813483247296e-13 1.5252721430016e-13 4.870616927232e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.501021 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.124407992792984e-18 } }