{ "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" [ [ 1.248143 2.607252 2.065498 ] [ 1.369551 0.7649094 4.123488 ] [ 1.757865 4.314259 0.9683886 ] [ 3.278515 2.86873 1.593912 ] [ 3.883205 5.101974 1.552288 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.248143e-10 2.607252e-10 2.065498e-10 ] [ 1.369551e-10 7.649094e-11 4.123488e-10 ] [ 1.757865e-10 4.314259e-10 9.683886000000001e-11 ] [ 3.278515e-10 2.86873e-10 1.593912e-10 ] [ 3.883205e-10 5.101974000000001e-10 1.552288e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.5347706 -5.307845 3.8768714 ] [ 0.0 0.0 0.0 ] [ -1.285238 7.5120228 -3.8066932 ] [ 8.4551102 -0.6807043 0.2084463 ] [ -0.6351016 -1.5234735 -0.2786244 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.046985667761119e-08 -8.504105165830176e-09 6.211432718928166e-09 ] [ 0.0 0.0 0.0 ] [ -2.059178275763751e-09 1.203558730507655e-08 -6.098994847598339e-09 ] [ 1.354657988872761e-08 -1.090608515138029e-09 3.33967788552263e-10 ] [ -1.017544935352673e-09 -2.440873624108349e-09 -4.464054996644275e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -3.678892 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.894234752848154e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3125863 2.5575541 1.8091757 ] [ 1.369551 0.7649094 4.123488 ] [ 1.5627327 4.6639274 1.1392496 ] [ 3.5211312 2.7821837 1.9508079 ] [ 3.7712778 4.8885498 1.2808534 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3125863e-10 2.5575541e-10 1.8091757e-10 ] [ 1.369551e-10 7.649094e-11 4.123488e-10 ] [ 1.5627327e-10 4.663927400000001e-10 1.1392496e-10 ] [ 3.5211312e-10 2.7821837e-10 1.9508079e-10 ] [ 3.7712778e-10 4.8885498e-10 1.2808534e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7e-07 -7.44e-05 3.95e-05 ] [ 0.0 0.0 0.0 ] [ -0.0001475 7.51e-05 -5.42e-05 ] [ 1.02e-05 1.51e-05 -1.91e-05 ] [ 0.000138 -1.58e-05 3.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.12152363456e-15 -1.1920194058752e-13 6.32859765216e-14 ] [ 0.0 0.0 0.0 ] [ -2.36321051568e-13 1.2032346422208e-13 -8.683797284736e-14 ] [ 1.634220153216e-14 2.419286697408e-14 -3.060157345728e-14 ] [ 2.211003736704e-13 -2.531439060864e-14 5.415356978304e-14 ] ] } "relaxed-potential-energy" { "source-value" -7.549696 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.209594642534728e-18 } }