{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.748946000000001e-11 2.513714e-11 7.838345e-11 ] [ -1.475535e-11 -2.060946e-11 2.7496575e-10 ] [ 6.132978999999999e-11 1.8253839e-10 2.3350997e-10 ] [ 2.032498e-10 1.157687e-11 2.6032549e-10 ] [ 2.4390156e-10 1.6804705e-10 1.0879201e-10 ] [ 2.5965357e-10 2.1504961e-10 3.2509423e-10 ] ] "source-value" [ [ 0.7748946 0.2513714 0.7838345 ] [ -0.1475535 -0.2060946 2.7496575 ] [ 0.6132979 1.8253839 2.3350997 ] [ 2.032498 0.1157687 2.6032549 ] [ 2.4390156 1.6804705 1.0879201 ] [ 2.5965357 2.1504961 3.2509423 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.28518451424704e-12 -3.11046569162112e-12 6.3390118001952e-12 ] [ 1.5925635610752e-12 4.397974824096e-13 -5.96794769481792e-12 ] [ -3.03596447875392e-12 -1.47912945632256e-12 5.81093438597952e-12 ] [ -4.19113382235072e-12 5.7966750140544e-13 2.35391789127936e-12 ] [ 8.07432929818368e-12 4.81822575173184e-12 -5.66673849010752e-12 ] [ -1.5444982624512e-13 -1.24825580526528e-12 -2.86901767486656e-12 ] ] "source-value" [ [ -0.0014263 -0.0019414 0.0039565 ] [ 0.000994 0.0002745 -0.0037249 ] [ -0.0018949 -0.0009232 0.0036269 ] [ -0.0026159 0.0003618 0.0014692 ] [ 0.0050396 0.0030073 -0.0035369 ] [ -9.64e-05 -0.0007791 -0.0017907 ] ] } "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" -6.2495810249224e-18 "source-value" -39.006817 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 9.39697848982958e-08 -9.489906864730887e-08 -2.075578248580503e-07 ] [ -1.826016641189667e-07 -4.705374824849582e-07 2.558099730045743e-07 ] [ 4.681019399433379e-08 5.514392244861033e-07 -6.376940319600592e-08 ] [ -1.990714485776176e-07 -7.869626298599554e-07 -5.004899707741657e-08 ] [ -1.448415730501824e-10 3.279415120153882e-08 -9.111858887485305e-08 ] [ 2.410379750565696e-07 7.681658051443626e-07 1.566848410017516e-07 ] ] "source-value" [ [ 58.651327 -59.2313403 -129.5474058 ] [ -113.9709953 -293.6863991 159.6640281 ] [ 29.2166253 344.1812952 -39.8017312 ] [ -124.2506263 -491.1834436 -31.2381272 ] [ -0.090403 20.4684994 -56.8717504 ] [ 150.4440721 479.4513883 97.7949865 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.267845122133049e-17 "source-value" 79.132669 } "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 }