{ "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" [ [ 1.305811 2.49596 1.153083 ] [ 2.737889 0.6120376 2.536176 ] [ 2.287817 4.454983 1.771215 ] [ 3.462438 1.614504 0.7986264 ] [ 3.194185 2.806829 3.238803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.305811e-10 2.49596e-10 1.153083e-10 ] [ 2.737889e-10 6.120375999999999e-11 2.536176e-10 ] [ 2.287817e-10 4.454983e-10 1.771215e-10 ] [ 3.462438e-10 1.614504e-10 7.986264e-11 ] [ 3.194185e-10 2.806829e-10 3.238803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 7.1198467 5.7519161 1.325923 ] [ 0.9872094 5.8242373 4.0655997 ] [ -0.6300613 -12.3031939 2.7530305 ] [ -3.0298325 2.0956803 -1.3846478 ] [ -4.4471624 -1.3686398 -6.7599054 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.140725192642003e-08 9.215585500223115e-09 2.124362831580998e-09 ] [ 1.581683820513996e-09 9.331456836051316e-09 6.513808788871494e-09 ] [ -1.009469484530855e-09 -1.971188962774918e-08 4.410841103449334e-09 ] [ -4.854326796440016e-09 3.357649981331131e-09 -2.218450333202154e-09 ] [ -7.125139626180818e-09 -2.192802689856388e-09 -1.083056239069967e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.7845032 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.086997241078279e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8106721 3.0166959 0.3087842 ] [ 3.4154756 0.91305 2.7141675 ] [ 2.0612834 4.1778906 2.1723463 ] [ 2.6476019 0.9989112 0.6436506 ] [ 3.053107 2.8777659 3.6589548 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8106721e-10 3.0166959e-10 3.087842e-11 ] [ 3.4154756e-10 9.1305e-11 2.7141675e-10 ] [ 2.0612834e-10 4.1778906e-10 2.1723463e-10 ] [ 2.6476019e-10 9.989112e-11 6.436506e-11 ] [ 3.053107e-10 2.8777659e-10 3.6589548e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.9e-06 1.02e-05 9.8e-06 ] [ -6.7e-06 3e-07 -3.9e-06 ] [ 1.09e-05 -1.83e-05 5.3e-06 ] [ 1.02e-05 -4.4e-06 5.1e-06 ] [ -8.5e-06 1.23e-05 -1.64e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.45284206272e-15 1.634220153216e-14 1.570133088384e-14 ] [ -1.073458335936e-14 4.8065298624e-16 -6.24848882112e-15 ] [ 1.746372516672e-14 -2.931983216064e-14 8.491536090240001e-15 ] [ 1.634220153216e-14 -7.04957713152e-15 8.17110076608e-15 ] [ -1.36185012768e-14 1.970677243584e-14 -2.627569658112e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.370748 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.821794660660836e-18 } }