{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.6977917 0.2559248 0.8783031 ] [ 0.349385 0.3940236 2.698898 ] [ 1.248694 1.36901 2.090768 ] [ 0.3246804 2.316928 0.2892628 ] [ 2.775341 0.8800459 0.0497676 ] [ 2.033969 2.77175 0.0650166 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.977917e-11 2.559248e-11 8.783031e-11 ] [ 3.49385e-11 3.940236e-11 2.698898e-10 ] [ 1.248694e-10 1.36901e-10 2.090768e-10 ] [ 3.246804e-11 2.316928e-10 2.892628e-11 ] [ 2.775341e-10 8.800459e-11 4.976760000000001e-12 ] [ 2.033969e-10 2.77175e-10 6.50166e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.3108304 -23.2023861 -12.4992663 ] [ -7.2653718 -6.7661545 9.4297388 ] [ 9.7152152 7.1736874 33.5247015 ] [ 5.1464544 3.6148267 -13.8857844 ] [ -5.5386114 6.2312884 -5.4144357 ] [ 7.2531442 12.9487382 -11.1549538 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.491759478711391e-08 -3.717432055619489e-08 -2.002603224301332e-08 ] [ -1.164040883937961e-08 -1.084057455262071e-08 1.510810704561065e-08 ] [ 1.55654906594808e-08 1.149351423720754e-08 5.371249296259869e-08 ] [ 8.245528919693291e-09 5.791590826983616e-09 -2.224747912714936e-08 ] [ -8.873833696776357e-09 9.98362459194224e-09 -8.674882293364884e-09 ] [ 1.162081806453112e-08 2.074616561289987e-08 -1.787220618446412e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.5985314 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.367659499094693e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4482468 0.0504182 0.6190603 ] [ 0.0818932 -0.3850095 2.9622049 ] [ 1.3574388 1.6164256 2.5362991 ] [ 0.4581665 2.5307072 0.4021962 ] [ 2.6893124 1.1274788 0.4903227 ] [ 2.3948035 3.047662 -0.9380671 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.482468e-11 5.041820000000001e-12 6.190603e-11 ] [ 8.18932e-12 -3.850095e-11 2.9622049e-10 ] [ 1.3574388e-10 1.6164256e-10 2.5362991e-10 ] [ 4.581665e-11 2.5307072e-10 4.021962e-11 ] [ 2.6893124e-10 1.1274788e-10 4.903227e-11 ] [ 2.3948035e-10 3.047662e-10 -9.380671000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.33e-05 -1.82e-05 -5.24e-05 ] [ 2.22e-05 4.95e-05 -2.85e-05 ] [ -4.13e-05 -4.16e-05 0.0001198 ] [ -5.62e-05 6.31e-05 4.05e-05 ] [ 8.4e-06 -2.01e-05 -7.1e-06 ] [ 1.36e-05 -3.27e-05 -7.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.539601388864e-14 -2.915961449856e-14 -8.395405492992e-14 ] [ 3.556832098176e-14 7.930774272959999e-14 -4.56620336928e-14 ] [ -6.616989443904001e-14 -6.665054742528e-14 1.9194075917184e-13 ] [ -9.004232608896e-14 1.0109734477248e-13 6.488815314240001e-14 ] [ 1.345828361472e-14 -3.220375007808e-14 -1.137545400768e-14 ] [ 2.178960204288e-14 -5.239117550016001e-14 -1.1583736968384e-13 ] ] } "relaxed-potential-energy" { "source-value" -21.330672 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.417550398435318e-18 } }