{ "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" [ [ 2.8328 1.144076 3.909989 ] [ 1.831555 2.949109 3.983595 ] [ 4.980623 2.123246 2.998848 ] [ 3.28235 2.585733 1.880535 ] [ 4.448764 2.855471 5.04642 ] [ 4.331941 4.016039 3.033368 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8328e-10 1.144076e-10 3.909989e-10 ] [ 1.831555e-10 2.949109e-10 3.983595000000001e-10 ] [ 4.980622999999999e-10 2.123246e-10 2.998848e-10 ] [ 3.28235e-10 2.585733e-10 1.880535e-10 ] [ 4.448764e-10 2.855471e-10 5.04642e-10 ] [ 4.331941e-10 4.016039e-10 3.033368e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.7090823 -5.5821142 -0.6070773 ] [ 0.8136969 8.0117804 -1.0177571 ] [ 5.8157941 -9.3798698 1.2574946 ] [ -6.2820353 -2.1441005 -2.0832104 ] [ -3.2369819 -0.2761743 -1.3186738 ] [ -2.8195561 9.3704785 3.769224 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.146958262642977e-09 -8.943532939559602e-09 -9.726450650918081e-10 ] [ 1.303686160338234e-09 1.283628735361917e-08 -1.630626644707601e-09 ] [ 9.317929415175059e-09 -1.502820822352225e-08 2.014728465501176e-09 ] [ -1.006493017162318e-08 -3.435227722047717e-09 -3.337671026585793e-09 ] [ -5.186216764860924e-09 -4.424800103713061e-10 -2.112748350227989e-09 ] [ -4.517426901672167e-09 1.501316170209937e-08 6.038962621112015e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.301096 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.573029492379086e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0652302 1.0739425 3.832237 ] [ 2.1414365 3.2498048 3.9365823 ] [ 5.0945746 1.9747531 3.014336 ] [ 3.0580825 2.4497629 1.9072102 ] [ 4.1779284 2.7747952 5.0437081 ] [ 4.1707807 4.1506155 3.1186814 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0652302e-10 1.0739425e-10 3.832237e-10 ] [ 2.1414365e-10 3.2498048e-10 3.9365823e-10 ] [ 5.0945746e-10 1.9747531e-10 3.014336e-10 ] [ 3.0580825e-10 2.4497629e-10 1.9072102e-10 ] [ 4.1779284e-10 2.7747952e-10 5.0437081e-10 ] [ 4.1707807e-10 4.1506155e-10 3.1186814e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-07 -3e-06 -2.8e-06 ] [ -2.5e-06 2.6e-06 4.8e-06 ] [ -2e-07 -2.1e-06 -4.6e-06 ] [ 2.6e-06 -4.9e-06 -2.8e-06 ] [ -1.1e-06 3.3e-06 4.6e-06 ] [ 1.8e-06 4e-06 7e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.613059803999998e-16 -4.806529901999999e-15 -4.486094575199999e-15 ] [ -4.005441585e-15 4.165659248399999e-15 7.690447843199998e-15 ] [ -3.204353268e-16 -3.364570931399999e-15 -7.370012516399999e-15 ] [ 4.165659248399999e-15 -7.850665506599998e-15 -4.486094575199999e-15 ] [ -1.7623942974e-15 5.2871828922e-15 7.370012516399999e-15 ] [ 2.8839179412e-15 6.408706535999999e-15 1.1215236438e-15 ] ] } "relaxed-potential-energy" { "source-value" -26.519951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.248964582702493e-18 } }