{ "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" [ [ 1.803671 2.545248 2.102248 ] [ 1.259758 2.236074 4.250707 ] [ 2.077592 4.735817 2.343172 ] [ 2.945146 3.702359 3.858992 ] [ 3.151976 1.102961 3.497539 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.803671e-10 2.545248e-10 2.102248e-10 ] [ 1.259758e-10 2.236074e-10 4.250707e-10 ] [ 2.077592e-10 4.735817000000001e-10 2.343172e-10 ] [ 2.945146e-10 3.702359e-10 3.858992e-10 ] [ 3.151976e-10 1.102961e-10 3.497539e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2799761 -3.5514374 -8.0437272 ] [ -5.3596406 -1.9898504 5.5662295 ] [ -2.4208415 7.3912109 -5.4161268 ] [ 7.1362694 1.0572713 7.8005699 ] [ 2.9241889 -2.9071945 0.0930545 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.652924403402763e-09 -5.690029972514738e-09 -1.288747166393305e-08 ] [ -8.587090865210484e-09 -3.188091789769528e-09 8.918082770907274e-09 ] [ -3.878615653962403e-09 1.184202530338213e-08 -8.677591734248319e-09 ] [ 1.143356399241044e-08 1.693935358702823e-09 1.24978907226962e-08 ] [ 4.685067090382868e-09 -4.657839060018346e-09 1.490897443602336e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.1168261 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.800235770919243e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.4975609 2.4657669 1.9389872 ] [ 1.077905 2.0711859 4.4435964 ] [ 2.3228512 4.7115186 2.1191569 ] [ 3.0171191 3.7400615 4.2003135 ] [ 3.3227067 1.3339261 3.350604 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4975609e-10 2.4657669e-10 1.9389872e-10 ] [ 1.077905e-10 2.0711859e-10 4.4435964e-10 ] [ 2.3228512e-10 4.7115186e-10 2.1191569e-10 ] [ 3.0171191e-10 3.7400615e-10 4.2003135e-10 ] [ 3.3227067e-10 1.3339261e-10 3.350604e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.3e-06 8.1e-06 3e-07 ] [ 5.2e-06 -1e-07 3.9e-06 ] [ -4.6e-06 -2.2e-06 -1.64e-05 ] [ -1.6e-06 -9.4e-06 1.47e-05 ] [ -4.3e-06 3.6e-06 -2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.491536090240001e-15 1.297763062848e-14 4.8065298624e-16 ] [ 8.33131842816e-15 -1.6021766208e-16 6.24848882112e-15 ] [ -7.370012455680001e-15 -3.52478856576e-15 -2.627569658112e-14 ] [ -2.56348259328e-15 -1.506046023552e-14 2.355199632576e-14 ] [ -6.889359469440001e-15 5.76783583488e-15 -4.005441552e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.750145 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.722363098921002e-18 } }