{ "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" [ [ 0.563951 0.9225225 1.195567 ] [ 1.348432 0.3073599 2.755625 ] [ 0.2422324 2.903648 2.041824 ] [ 2.040932 0.0344744 0.838059 ] [ 2.055265 2.344707 1.01543 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.63951e-11 9.225225000000001e-11 1.195567e-10 ] [ 1.348432e-10 3.073599e-11 2.755625000000001e-10 ] [ 2.422324e-11 2.903648e-10 2.041824e-10 ] [ 2.040932e-10 3.447440000000001e-12 8.38059e-11 ] [ 2.055265e-10 2.344707e-10 1.01543e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -32.611069 9.2057482 -10.5506056 ] [ 4.4462698 -4.1900328 21.335985 ] [ -3.6981734 4.0290239 3.7696409 ] [ 22.991483 -14.6088151 -11.8820334 ] [ 8.8714896 5.5640758 -2.6729868 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.224869276156175e-08 1.474923466452756e-08 -1.690393376686955e-08 ] [ 7.123709582019852e-09 -6.713172647853594e-09 3.418401663037449e-08 ] [ -5.925127009960335e-09 6.455207950407553e-09 6.039630568550731e-09 ] [ 3.683641684360821e-08 -2.340590220364637e-08 -1.903711627788757e-08 ] [ 1.421369334589401e-08 8.914632236564857e-09 -4.28259699395043e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.92739378 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.485848644832936e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0748165 0.9234797 0.7694607 ] [ 1.4527863 0.715401 2.9031218 ] [ 0.2181863 2.7899789 2.3808389 ] [ 2.2821428 -0.184894 0.7577669 ] [ 2.2228805 2.2687463 1.0353166 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.481649999999999e-12 9.234797e-11 7.694607e-11 ] [ 1.4527863e-10 7.15401e-11 2.9031218e-10 ] [ 2.181863e-11 2.7899789e-10 2.3808389e-10 ] [ 2.2821428e-10 -1.84894e-11 7.577669000000001e-11 ] [ 2.2228805e-10 2.2687463e-10 1.0353166e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.77e-05 -1e-07 1.16e-05 ] [ 1.74e-05 -9.5e-06 -1.85e-05 ] [ -6e-06 8.9e-06 -1.75e-05 ] [ -1.77e-05 -3.5e-06 3.5e-06 ] [ -1.14e-05 4.1e-06 2.09e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.83585264218e-14 -1.602176634e-16 1.85852489544e-14 ] [ 2.78778734316e-14 -1.5220678023e-14 -2.9640267729e-14 ] [ -9.613059803999999e-15 1.42593720426e-14 -2.8038091095e-14 ] [ -2.83585264218e-14 -5.607618218999999e-15 5.607618218999999e-15 ] [ -1.82648136276e-14 6.568924199399999e-15 3.34854916506e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.29999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.291110984443366e-18 } }