{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.4120952e-10 -2.127646e-11 6.62764e-11 ] [ -2.40088e-11 9.77771e-12 2.5499048e-10 ] [ 3.047869e-11 2.436892e-10 2.636301e-10 ] [ 2.1641181e-10 -4.853304e-11 3.0594697e-10 ] [ 1.9583189e-10 2.1269379e-10 7.524484e-11 ] [ 2.709457e-10 1.853884e-10 3.1498211e-10 ] ] "source-value" [ [ 1.4120952 -0.2127646 0.662764 ] [ -0.240088 0.0977771 2.5499048 ] [ 0.3047869 2.436892 2.636301 ] [ 2.1641181 -0.4853304 3.0594697 ] [ 1.9583189 2.1269379 0.7524484 ] [ 2.709457 1.853884 3.1498211 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.90210408421376e-12 4.8658103973696e-13 -6.78089211221184e-12 ] [ -9.3134526967104e-12 -5.4802451314464e-12 -2.35183506167232e-12 ] [ -5.74075904998848e-12 9.67971027222528e-12 6.38867927544e-12 ] [ 4.511569146510721e-12 -1.64719778384448e-12 2.5130140297248e-12 ] [ 9.456046415961602e-13 -7.491617661198722e-12 -2.83441065985728e-12 ] [ 7.69493387437824e-12 4.452769264527359e-12 3.06544452857664e-12 ] ] "source-value" [ [ 0.0011872 0.0003037 -0.0042323 ] [ -0.005813 -0.0034205 -0.0014679 ] [ -0.0035831 0.0060416 0.0039875 ] [ 0.0028159 -0.0010281 0.0015685 ] [ 0.0005902 -0.0046759 -0.0017691 ] [ 0.0048028 0.0027792 0.0019133 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.532562987763491e-18 "source-value" -15.807015 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.093285071063296e-09 -3.040194801816416e-08 -6.176679024649251e-08 ] [ -4.385661455894503e-08 -3.37051898438472e-08 2.999616939172634e-08 ] [ -3.817438894896788e-08 5.571871112994423e-08 5.898098722204537e-09 ] [ 2.910481845595202e-08 -4.859184227453659e-08 2.670624389680941e-08 ] [ 2.317474237122592e-08 2.650760059196212e-08 -3.176263144082889e-08 ] [ 3.284472775179827e-08 3.047266841464159e-08 3.092890967658111e-08 ] ] "source-value" [ [ -1.9306767 -18.9754036 -38.5517985 ] [ -27.373146 -21.037125 18.7221365 ] [ -23.8265797 34.7768844 3.6813037 ] [ 18.165799 -30.3286427 16.6687265 ] [ 14.4645366 16.5447431 -19.8246754 ] [ 20.5000668 19.0195438 19.3043072 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 3.392652413530424e-18 "source-value" 21.175271 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.009597e-10 3.628337e-11 1.078601e-10 ] [ 3.523669e-12 1.167127e-11 2.680629e-10 ] [ 3.335965e-11 1.756245e-10 2.167544e-10 ] [ 2.066416e-10 7.297679e-13 2.832654e-10 ] [ 2.311694e-10 1.962933e-10 1.086024e-10 ] [ 2.552148e-10 1.611374e-10 2.965257e-10 ] ] "source-value" [ [ 1.009597 0.3628337 1.078601 ] [ 0.03523669 0.1167127 2.680629 ] [ 0.3335965 1.756245 2.167544 ] [ 2.066416 0.007297679 2.832654 ] [ 2.311694 1.962933 1.086024 ] [ 2.552148 1.611374 2.965257 ] ] } "instance-id" 1 }