{ "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" [ [ 0.7955699 1.924478 0.0578634 ] [ 0.2789322 2.342777 2.34838 ] [ 2.533834 0.6960937 0.5593318 ] [ 1.694509 0.4311754 2.932881 ] [ 2.816233 2.726519 1.407602 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.955699e-11 1.924478e-10 5.786340000000001e-12 ] [ 2.789322e-11 2.342777e-10 2.34838e-10 ] [ 2.533834e-10 6.960937e-11 5.593318000000001e-11 ] [ 1.694509e-10 4.311754e-11 2.932881e-10 ] [ 2.816233e-10 2.726519e-10 1.407602e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.9158679 1.5251662 -2.405523 ] [ 0.6683272 0.125731 0.6361695 ] [ 2.4267922 -5.1421594 0.262437 ] [ -0.2768748 -0.4823356 -0.2324747 ] [ 1.0976233 3.9735979 1.7393911 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.273911999521192e-09 2.443585628474377e-09 -3.854072711396679e-09 ] [ 1.070778214884726e-09 2.014432687098048e-10 1.019255899766026e-09 ] [ 3.888149726379798e-09 -8.238647571106955e-09 4.204704258328895e-10 ] [ -4.436023314486758e-10 -7.727868216995405e-10 -3.724655292674938e-10 ] [ 1.758586389705344e-09 6.366405655839976e-09 2.786811754847595e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.3063634 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.49104378641488e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.716123 2.0563961 -0.1222481 ] [ 0.6362425 2.2635205 2.4381433 ] [ 2.5771561 0.5862452 0.867757 ] [ 1.4911982 0.0800541 2.9465613 ] [ 2.6983583 3.1348271 1.1758447 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.16123e-11 2.0563961e-10 -1.222481e-11 ] [ 6.362425000000001e-11 2.2635205e-10 2.4381433e-10 ] [ 2.5771561e-10 5.862452e-11 8.677570000000001e-11 ] [ 1.4911982e-10 8.00541e-12 2.9465613e-10 ] [ 2.6983583e-10 3.1348271e-10 1.1758447e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.42e-05 -6e-06 1.27e-05 ] [ 1.44e-05 -4.9e-06 -1.7e-05 ] [ -1.9e-05 1.05e-05 -3.7e-06 ] [ 3.7e-06 9.5e-06 -1.5e-06 ] [ -1.33e-05 -9.1e-06 9.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.275090801536e-14 -9.6130597248e-15 2.034764308416e-14 ] [ 2.307134333952e-14 -7.850665441919999e-15 -2.72370025536e-14 ] [ -3.04413557952e-14 1.68228545184e-14 -5.928053496960001e-15 ] [ 5.928053496960001e-15 1.52206778976e-14 -2.4032649312e-15 ] [ -2.130894905664e-14 -1.457980724928e-14 1.52206778976e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.750145 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.722363098921002e-18 } }