{ "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" [ [ 1.839954 1.796871 1.93364 ] [ 2.210383 3.445619 3.048606 ] [ 3.819674 1.353604 3.225037 ] [ 4.546382 3.666644 2.852587 ] [ 3.625014 3.17012 0.7912526 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.839954e-10 1.796871e-10 1.93364e-10 ] [ 2.210383e-10 3.445619e-10 3.048606e-10 ] [ 3.819674e-10 1.353604e-10 3.225037e-10 ] [ 4.546382e-10 3.666644e-10 2.852587000000001e-10 ] [ 3.625014e-10 3.17012e-10 7.912526e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5041157 -7.3010039 -5.866895 ] [ 1.7437111 7.6863326 5.2633203 ] [ -0.2304203 0.4340234 0.4047756 ] [ 0.3104891 -0.5410412 0.3620791 ] [ -1.3196642 -0.2783109 -0.16328 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.076823887182266e-10 -1.169749775694962e-08 -9.399802005688416e-09 ] [ 2.793733157849451e-09 1.231486239141288e-08 8.432768732442043e-09 ] [ -3.691740176177222e-10 6.953821443601268e-10 6.485220029902925e-10 ] [ 4.974583770332333e-10 -8.66843561529577e-10 5.801146689003052e-10 ] [ -2.114335128546735e-09 -4.459032172938068e-10 -2.61603398644224e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.431008 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.991667039057777e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0545822 1.8504086 1.8284882 ] [ 2.116602 3.6317136 3.3612651 ] [ 3.8300561 1.322726 3.2760866 ] [ 4.3938453 3.5511045 2.7833701 ] [ 3.6463215 3.0769053 0.6019126 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0545822e-10 1.8504086e-10 1.8284882e-10 ] [ 2.116602e-10 3.6317136e-10 3.3612651e-10 ] [ 3.8300561e-10 1.322726e-10 3.2760866e-10 ] [ 4.3938453e-10 3.5511045e-10 2.7833701e-10 ] [ 3.6463215e-10 3.0769053e-10 6.019126e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.8e-05 4.64e-05 3.27e-05 ] [ -6.2e-06 -4.3e-06 1.58e-05 ] [ 5.2e-06 5.9e-06 -1.93e-05 ] [ -5.79e-05 -2.75e-05 -4.2e-06 ] [ 2.09e-05 -2.04e-05 -2.5e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.08827115904e-14 7.434099520512001e-14 5.239117550016001e-14 ] [ -9.93349504896e-15 -6.889359469440001e-15 2.531439060864e-14 ] [ 8.33131842816e-15 9.45284206272e-15 -3.092200878144e-14 ] [ -9.276602634432e-14 -4.4059857072e-14 -6.72914180736e-15 ] [ 3.348549137472e-14 -3.268440306432e-14 -4.005441552e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.191316 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.273699471358497e-18 } }