{ "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" [ [ -2.1445 -1.0532414 -1.9593341 ] [ -1.3886575 -2.7107901 3.1475858 ] [ 0.2901618 1.6502213 0.9070224 ] [ 1.849589 0.9590339 -3.475285 ] [ 1.3934067 1.1547762 1.3800109 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.435867791612999e-09 -1.687478761041448e-09 -3.139199313219419e-09 ] [ -2.224874599128855e-09 -4.343164557898523e-09 5.042988422270197e-09 ] [ 4.648904560393812e-10 2.643946007789104e-09 1.453210095794601e-09 ] [ 2.963368278303425e-09 1.536541705793893e-09 -5.56802042349069e-09 ] [ 2.232483656399048e-09 1.85015544513931e-09 2.21102121864531e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.21776104636885 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.476848136628756e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1505223 2.4642349 1.0960051 ] [ 2.8500023 0.594966 2.6518627 ] [ 2.5135102 4.3547157 1.7093358 ] [ 3.4196229 1.7500489 0.6149272 ] [ 3.0544822 2.8203481 3.4257726 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1505223e-10 2.4642349e-10 1.0960051e-10 ] [ 2.8500023e-10 5.94966e-11 2.6518627e-10 ] [ 2.5135102e-10 4.3547157e-10 1.7093358e-10 ] [ 3.4196229e-10 1.7500489e-10 6.149272e-11 ] [ 3.0544822e-10 2.8203481e-10 3.4257726e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.62e-05 -9.4e-06 1.3e-05 ] [ -2.29e-05 -1.52e-05 1.36e-05 ] [ -7.8e-06 -7e-07 4e-06 ] [ 1.7e-06 1.74e-05 -1.39e-05 ] [ 2.7e-06 8e-06 -1.67e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.197702781079999e-14 -1.50604603596e-14 2.082829624199999e-14 ] [ -3.66898449186e-14 -2.43530848368e-14 2.17896022224e-14 ] [ -1.24969777452e-14 -1.1215236438e-15 6.408706535999999e-15 ] [ 2.7237002778e-15 2.78778734316e-14 -2.22702552126e-14 ] [ 4.3258769118e-15 1.2817413072e-14 -2.67563497878e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.02498704636885 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.766397663584484e-18 } }