{ "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" [ [ 2.91343 2.805447 1.311156 ] [ 2.653002 2.505168 3.277079 ] [ 1.829519 4.618852 2.376516 ] [ 4.982305 1.900488 2.423676 ] [ 4.143762 3.996307 2.985709 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.91343e-10 2.805447e-10 1.311156e-10 ] [ 2.653002e-10 2.505168e-10 3.277079e-10 ] [ 1.829519e-10 4.618852000000001e-10 2.376516e-10 ] [ 4.982305e-10 1.900488e-10 2.423676e-10 ] [ 4.143762e-10 3.996307e-10 2.985709e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8181748 -2.8330039 -13.7059441 ] [ -6.791003 -7.8487801 10.7698893 ] [ -4.1384642 5.0587775 -0.3642464 ] [ 4.3058873 -3.325008 -0.5765811 ] [ 8.4417546 8.9480145 3.8768824 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.913037157087716e-09 -4.538972615215221e-09 -2.19593432030117e-08 ] [ -1.088038623838266e-08 -1.257513197802029e-08 1.725526484506408e-08 ] [ -6.630550587257775e-09 8.105055040329071e-09 -5.835870662905652e-10 ] [ 6.898791963859636e-09 -5.327250081572967e-09 -9.237847584151469e-10 ] [ 1.352518185865085e-08 1.43362996344794e-08 6.211450342870994e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.3202898 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.012622055424071e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6855628 2.4762738 0.9449746 ] [ 2.5377106 2.3238137 3.5726408 ] [ 2.2037916 4.5468605 2.1956441 ] [ 4.7883277 2.2043245 2.2051594 ] [ 4.3066252 4.2749896 3.455717 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6855628e-10 2.4762738e-10 9.449746e-11 ] [ 2.5377106e-10 2.3238137e-10 3.5726408e-10 ] [ 2.2037916e-10 4.5468605e-10 2.1956441e-10 ] [ 4.7883277e-10 2.2043245e-10 2.2051594e-10 ] [ 4.3066252e-10 4.2749896e-10 3.455717e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.97e-05 -1.39e-05 2.28e-05 ] [ 2.19e-05 1.99e-05 -9.8e-06 ] [ 3.81e-05 -1.55e-05 2e-06 ] [ -4.81e-05 2.49e-05 -2.26e-05 ] [ -3.15e-05 -1.54e-05 7.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.156287942976e-14 -2.227025502912e-14 3.652962695424e-14 ] [ 3.508766799552e-14 3.188331475392e-14 -1.570133088384e-14 ] [ 6.104292925248e-14 -2.48337376224e-14 3.2043532416e-15 ] [ -7.706469546047999e-14 3.989419785791999e-14 -3.620919163008e-14 ] [ -5.04685635552e-14 -2.467351996032e-14 1.233675998016e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.901027 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.906754722290956e-18 } }