{ "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" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1409085 2.5000808 -1.7343466 ] [ 2.0179191 -1.0193154 -0.7904451 ] [ 0.021331 0.9907847 1.2311489 ] [ -1.1228502 -3.3226868 0.6546767 ] [ 1.9480179 -0.5184593 -0.5214628 ] [ -1.0681217 -0.0440446 0.9385734 ] [ -0.6553875 1.4136406 0.2218555 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.827936940231989e-09 4.005571040872027e-09 -2.778729597777344e-09 ] [ 3.233062831322309e-09 -1.633123316556364e-09 -1.266432669679793e-09 ] [ 3.4176029779854e-11 1.5874120956647e-09 1.972518000554802e-09 ] [ -1.799004353922227e-09 -5.32353115306023e-09 1.048907711564228e-09 ] [ 3.121068761993748e-09 -8.306633761399961e-10 -8.354755136602152e-10 ] [ -1.711319630008358e-09 -7.05672289738764e-11 1.503760370773935e-09 ] [ -1.050046538715675e-09 2.26490193819374e-09 3.554516982243869e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.709681 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.157839036179375e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8543634 3.8216077 3.0466592 ] [ 5.5539357 2.4109213 1.1541794 ] [ 3.5258531 1.0958825 1.1066618 ] [ 3.149662 1.4446337 3.3745118 ] [ 5.1503957 2.785022 3.5869196 ] [ 4.9272916 4.6570517 1.9834343 ] [ 3.2579035 3.4475014 0.6139209 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8543634e-10 3.8216077e-10 3.0466592e-10 ] [ 5.553935700000001e-10 2.4109213e-10 1.1541794e-10 ] [ 3.5258531e-10 1.0958825e-10 1.1066618e-10 ] [ 3.149662e-10 1.4446337e-10 3.3745118e-10 ] [ 5.1503957e-10 2.785022e-10 3.5869196e-10 ] [ 4.9272916e-10 4.6570517e-10 1.9834343e-10 ] [ 3.2579035e-10 3.4475014e-10 6.139209e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.1e-06 4.3e-06 1.4e-06 ] [ -9.9e-06 -4.6e-06 1.13e-05 ] [ 5e-07 8.8e-06 -5e-06 ] [ 3.6e-06 -8.6e-06 -5.7e-06 ] [ 1.05e-05 8e-07 1.48e-05 ] [ 6.8e-06 7e-06 -1.2e-06 ] [ -1.36e-05 -7.7e-06 -1.56e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.364570931399999e-15 6.8893595262e-15 2.2430472876e-15 ] [ -1.58615486766e-14 -7.370012516399999e-15 1.81045959642e-14 ] [ 8.010883169999999e-16 1.40991543792e-14 -8.010883169999999e-15 ] [ 5.767835882399999e-15 -1.37787190524e-14 -9.1324068138e-15 ] [ 1.6822854657e-14 1.2817413072e-15 2.37122141832e-14 ] [ 1.08948011112e-14 1.1215236438e-14 -1.9226119608e-15 ] [ -2.17896022224e-14 -1.23367600818e-14 -2.49939554904e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.152427 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.549210092579071e-18 } }