{ "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" [ [ 2.700129 2.133533 1.415237 ] [ 2.985807 2.812498 3.555959 ] [ 1.950344 4.41901 2.566342 ] [ 5.113997 2.527784 1.58139 ] [ 5.483026 3.06067 3.469124 ] [ 3.944653 4.730231 1.719663 ] [ 3.598129 4.831394 3.870985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700129e-10 2.133533e-10 1.415237e-10 ] [ 2.985807e-10 2.812498e-10 3.555959e-10 ] [ 1.950344e-10 4.41901e-10 2.566342e-10 ] [ 5.113997e-10 2.527784e-10 1.58139e-10 ] [ 5.483026e-10 3.06067e-10 3.469124e-10 ] [ 3.944653e-10 4.730231e-10 1.719663e-10 ] [ 3.598129e-10 4.831394000000001e-10 3.870985e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2371462 -6.7496768 -5.271213 ] [ -7.1571223 -17.7499172 15.0565218 ] [ -16.2230397 5.5052638 -4.6958912 ] [ 3.9922277 -3.7961687 -9.907923 ] [ 7.7391496 -1.8254549 8.777386 ] [ 8.2021234 13.7994301 -16.6208606 ] [ 5.6838075 10.8165237 12.66198 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.584303338951561e-09 -1.081417436691616e-08 -8.445414231857032e-09 ] [ -1.146697402126632e-08 -2.84385023589758e-08 2.412320721852554e-08 ] [ -2.599217492565025e-08 8.820404951696565e-09 -7.523647094460458e-09 ] [ 6.396253885850156e-09 -6.082132739752729e-09 -1.58742425912866e-08 ] [ 1.239948455399367e-08 -2.924701163104802e-09 1.406292264093723e-08 ] [ 1.314125035239661e-08 2.210912428658381e-08 -2.662955427089586e-08 ] [ 9.106463493627696e-09 1.732998139046911e-08 2.028672832903718e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.2093068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.539699703134461e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5284867 2.2180099 1.7949078 ] [ 3.1528402 1.5228034 4.0016268 ] [ 1.9898985 4.5255701 2.1544869 ] [ 4.855172 2.8772498 1.4267393 ] [ 5.0191761 3.0195892 3.863222 ] [ 4.3105581 5.2051769 1.1804549 ] [ 3.9199534 5.1467206 3.7572624 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5284867e-10 2.2180099e-10 1.7949078e-10 ] [ 3.1528402e-10 1.5228034e-10 4.0016268e-10 ] [ 1.9898985e-10 4.525570100000001e-10 2.1544869e-10 ] [ 4.855171999999999e-10 2.8772498e-10 1.4267393e-10 ] [ 5.019176100000001e-10 3.0195892e-10 3.863222e-10 ] [ 4.3105581e-10 5.2051769e-10 1.1804549e-10 ] [ 3.9199534e-10 5.1467206e-10 3.7572624e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.66e-05 -4.2e-06 -1.42e-05 ] [ -4.1e-06 7.5e-06 -8.3e-06 ] [ -8e-06 5.3e-06 2.64e-05 ] [ 2.88e-05 5.5e-06 -5.9e-06 ] [ 1.7e-05 -1e-07 4.04e-05 ] [ 2e-06 3.5e-06 -5.23e-05 ] [ -9.1e-06 -1.75e-05 1.39e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.261789811328e-14 -6.72914180736e-15 -2.275090801536e-14 ] [ -6.568924145279999e-15 1.2016324656e-14 -1.329806595264e-14 ] [ -1.28174129664e-14 8.491536090240001e-15 4.229746278912e-14 ] [ 4.614268667904e-14 8.8119714144e-15 -9.45284206272e-15 ] [ 2.72370025536e-14 -1.6021766208e-16 6.472793548032e-14 ] [ 3.2043532416e-15 5.6076181728e-15 -8.379383726784e-14 ] [ -1.457980724928e-14 -2.8038090864e-14 2.227025502912e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.875973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864046601465204e-18 } }