{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0299584 0.6173503 0.5342358 ] [ 0.7975385 2.616511 1.362514 ] [ 1.80202 0.5667157 2.620782 ] [ 2.455492 1.646275 1.01187 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.99584e-12 6.173503e-11 5.342358000000001e-11 ] [ 7.975385000000001e-11 2.616511e-10 1.362514e-10 ] [ 1.80202e-10 5.667157e-11 2.620782e-10 ] [ 2.455492e-10 1.646275e-10 1.01187e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.9140182 -2.7835871 -3.5769949 ] [ -17.082157 14.7039159 1.2919794 ] [ 0.4781089 -10.1334619 13.6652571 ] [ 22.5180663 -1.786867 -11.3802416 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.4753016950257e-09 -4.459798173580472e-09 -5.730977601500834e-09 ] [ -2.736863257823506e-08 2.355827028918939e-08 2.069979189235211e-09 ] [ 7.660149017764051e-10 -1.623559574394755e-08 2.189415544284121e-08 ] [ 3.607791937148436e-08 -2.862876531879034e-09 -1.823315703057559e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.9449573 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.116165114514292e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.3820909 0.6280563 1.2731674 ] [ 0.6555608 2.8678903 0.5849216 ] [ 1.8869181 -0.1444207 2.1798802 ] [ 2.9246208 2.0953262 1.4914326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.820909e-11 6.280563e-11 1.2731674e-10 ] [ 6.555608e-11 2.8678903e-10 5.849216e-11 ] [ 1.8869181e-10 -1.444207e-11 2.1798802e-10 ] [ 2.9246208e-10 2.0953262e-10 1.4914326e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.39e-05 2.9e-06 1.68e-05 ] [ -2.24e-05 4.12e-05 -4.99e-05 ] [ 3.02e-05 -6.55e-05 8.9e-06 ] [ 2.61e-05 2.14e-05 2.42e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.431378744512e-14 4.646312200320001e-15 2.691656722944e-14 ] [ -3.588875630592e-14 6.600967677696001e-14 -7.994861337792e-14 ] [ 4.838573394816e-14 -1.049425686624e-13 1.425937192512e-14 ] [ 4.181680980288e-14 3.428657968511999e-14 3.877267422336e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.704511 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.715051726129643e-18 } }