{ "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" [ [ 2.246807 1.041122 2.124463 ] [ 1.267764 1.326115 3.99765 ] [ 2.011294 2.700157 5.439591 ] [ 2.31677 3.176049 2.822929 ] [ 4.533635 0.1687206 2.857812 ] [ 4.258439 2.493804 2.204153 ] [ 4.092776 1.731475 4.602458 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.246807e-10 1.041122e-10 2.124463e-10 ] [ 1.267764e-10 1.326115e-10 3.99765e-10 ] [ 2.011294e-10 2.700157e-10 5.439591000000001e-10 ] [ 2.31677e-10 3.176049e-10 2.822929e-10 ] [ 4.533635000000001e-10 1.687206e-11 2.857812e-10 ] [ 4.258439e-10 2.493804e-10 2.204153e-10 ] [ 4.092776e-10 1.731475e-10 4.602458e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4785866 -5.6758477 -6.1905217 ] [ -9.6001089 -4.709283 0.8712432 ] [ 1.9271921 3.6540258 3.6393359 ] [ -7.049135 9.4165733 -0.5730137 ] [ 0.2985117 -2.2127132 -0.6838102 ] [ 5.8646987 0.5002706 -2.3760472 ] [ 7.080255 -0.9730259 5.3128137 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.368956901865504e-09 -9.093710563082642e-09 -9.918309220009955e-09 ] [ -1.538107016343544e-08 -7.545103185493421e-09 1.395885497571389e-09 ] [ 3.087702151849391e-09 5.854394756793157e-09 5.83085894225736e-09 ] [ -1.129395938691159e-08 1.508701371360827e-08 -9.180691611018856e-10 ] [ 4.782684707156177e-10 -3.545157386783369e-09 -1.095584724530867e-09 ] [ 9.396283222590175e-09 8.015218659971603e-10 -3.806847305121124e-09 ] [ 1.134381912376167e-08 -1.55895936125682e-09 8.512065970935085e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.413209 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.988815341275851e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3155892 0.8678968 1.9835376 ] [ 0.6958372 1.3109587 3.8680761 ] [ 2.3579063 2.5778039 5.2743239 ] [ 1.969743 3.3607166 2.8685136 ] [ 4.493861 0.0716909 2.9798128 ] [ 4.3228907 2.5929044 2.3181937 ] [ 4.5716576 1.8554712 4.7565983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3155892e-10 8.678968e-11 1.9835376e-10 ] [ 6.958372000000001e-11 1.3109587e-10 3.8680761e-10 ] [ 2.3579063e-10 2.5778039e-10 5.2743239e-10 ] [ 1.969743e-10 3.3607166e-10 2.8685136e-10 ] [ 4.493861e-10 7.16909e-12 2.9798128e-10 ] [ 4.322890700000001e-10 2.5929044e-10 2.3181937e-10 ] [ 4.5716576e-10 1.8554712e-10 4.756598300000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.7e-06 1.93e-05 2.9e-05 ] [ -1.2e-06 -1.02e-05 -1.45e-05 ] [ -3.02e-05 1.93e-05 1.15e-05 ] [ 5.8e-06 -1.76e-05 1.83e-05 ] [ 2.5e-06 -5.1e-06 -2.65e-05 ] [ 2.2e-05 -1.42e-05 -2.68e-05 ] [ 4.9e-06 8.5e-06 9.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.9280535458e-15 3.09220090362e-14 4.6463122386e-14 ] [ -1.9226119608e-15 -1.63422016668e-14 -2.3231561193e-14 ] [ -4.838573434679999e-14 3.09220090362e-14 1.8425031291e-14 ] [ 9.2926244772e-15 -2.81983087584e-14 2.93198324022e-14 ] [ 4.005441585e-15 -8.1711008334e-15 -4.2457680801e-14 ] [ 3.5247885948e-14 -2.27509082028e-14 -4.293833379119999e-14 ] [ 7.850665506599998e-15 1.3618501389e-14 1.45798073694e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.993828 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.722711414381495e-18 } }