{ "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" [ [ 0.9312002 0.7437347 1.637203 ] [ 0.2868751 2.587784 1.486301 ] [ 2.468756 0.0419283 1.950884 ] [ 2.101698 2.93019 0.1307908 ] [ 2.374683 2.856414 2.678274 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.312002000000001e-11 7.437347e-11 1.637203e-10 ] [ 2.868751e-11 2.587784e-10 1.486301e-10 ] [ 2.468756e-10 4.19283e-12 1.950884e-10 ] [ 2.101698e-10 2.93019e-10 1.307908e-11 ] [ 2.374683e-10 2.856414e-10 2.678274e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7691958 -1.890173 -0.5437035 ] [ -0.2521947 2.7827736 0.0287603 ] [ 2.3857529 0.9524526 0.89534 ] [ -0.0571192 -0.2874638 0.9392564 ] [ -0.3072432 -1.5575893 -1.3196532 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.834564171730937e-09 -3.028391014817682e-09 -8.711090435240189e-10 ] [ -4.040604555586397e-10 4.458494839632062e-09 4.60790806468302e-11 ] [ 3.822397550877738e-09 1.525997300712548e-09 1.43449282748556e-09 ] [ -9.15150475927728e-11 -4.605677834808491e-10 1.504854657414957e-09 ] [ -4.922578759953888e-10 -2.495533181828416e-09 -2.114317522023329e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.050087 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.770419119506716e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5375905 0.5980074 1.1380874 ] [ 0.2788242 2.8421626 1.8237384 ] [ 2.7485331 0.6000688 1.965757 ] [ 2.1085062 2.2755952 0.3044402 ] [ 2.4897584 2.8442168 2.6514298 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.375905e-11 5.980074e-11 1.1380874e-10 ] [ 2.788242e-11 2.8421626e-10 1.8237384e-10 ] [ 2.7485331e-10 6.000688e-11 1.965757e-10 ] [ 2.1085062e-10 2.2755952e-10 3.044402e-11 ] [ 2.4897584e-10 2.8442168e-10 2.6514298e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.8e-06 8.6e-06 2.9e-06 ] [ -6e-07 -6.2e-06 5.9e-06 ] [ -4.8e-06 2.1e-06 8.1e-06 ] [ 3.3e-06 4.1e-06 -1.03e-05 ] [ -3.7e-06 -8.6e-06 -6.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.2926244772e-15 1.37787190524e-14 4.6463122386e-15 ] [ -9.613059803999998e-16 -9.9334951308e-15 9.452842140600001e-15 ] [ -7.690447843199998e-15 3.364570931399999e-15 1.29776307354e-14 ] [ 5.2871828922e-15 6.568924199399999e-15 -1.65024193302e-14 ] [ -5.9280535458e-15 -1.37787190524e-14 -1.0414148121e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971627206706e-18 } }