{ "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" [ [ 2.10043 2.130682 2.453785 ] [ 1.948071 1.785129 4.606922 ] [ 2.343053 4.336787 1.957735 ] [ 4.413531 1.079857 2.965455 ] [ 3.524463 3.435576 3.796327 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.10043e-10 2.130682e-10 2.453785e-10 ] [ 1.948071e-10 1.785129e-10 4.606922e-10 ] [ 2.343053e-10 4.336787e-10 1.957735e-10 ] [ 4.413531e-10 1.079857e-10 2.965455e-10 ] [ 3.524463e-10 3.435576e-10 3.796327e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.2662946 -9.4827186 -12.5505736 ] [ -8.7002007 -3.6626899 11.2518576 ] [ -1.7335799 7.0262865 -4.8168928 ] [ 8.6298692 -5.7507817 -3.4622731 ] [ 12.0702059 11.8699037 9.577882 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.644841719036529e-08 -1.519299004254531e-08 -2.010823559954969e-08 ] [ -1.393925815780779e-08 -5.86827612702029e-09 1.80274631872908e-08 ] [ -2.777501186068802e-09 1.125735196134266e-08 -7.717513029059851e-09 ] [ 1.3826574672802e-08 -9.21376799106448e-09 -5.54717301564474e-09 ] [ 1.933860170122222e-08 1.901768219928742e-08 1.534545861718115e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 2.3020894 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.6883538156715e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8825397 1.6279086 2.1537678 ] [ 1.7364474 2.0776722 4.7037964 ] [ 2.4472388 4.1582402 2.0847859 ] [ 4.4140471 1.4249045 2.6795668 ] [ 3.8492751 3.4793056 4.158307 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8825397e-10 1.6279086e-10 2.1537678e-10 ] [ 1.7364474e-10 2.0776722e-10 4.7037964e-10 ] [ 2.4472388e-10 4.1582402e-10 2.0847859e-10 ] [ 4.4140471e-10 1.4249045e-10 2.6795668e-10 ] [ 3.8492751e-10 3.4793056e-10 4.158307e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.83e-05 5.9e-05 8.4e-05 ] [ 7e-06 1.18e-05 -6.31e-05 ] [ 5.3e-06 -6.03e-05 1.81e-05 ] [ -3.02e-05 4.05e-05 -3.9e-06 ] [ -3.03e-05 -5.1e-05 -3.5e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.738513078464e-14 9.45284206272e-14 1.345828361472e-13 ] [ 1.12152363456e-14 1.890568412544e-14 -1.0109734477248e-13 ] [ 8.491536090240001e-15 -9.661125023424001e-14 2.899939683648e-14 ] [ -4.838573394816e-14 6.488815314240001e-14 -6.24848882112e-15 ] [ -4.854595161024e-14 -8.17110076608e-14 -5.6076181728e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.8977283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.425573226049053e-18 } }