{ "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" [ [ 0.8495841 0.5267621 0.8966685 ] [ 0.1884113 0.623136 2.979456 ] [ 1.483282 2.75051 2.967402 ] [ 1.97645 1.30316 2.052926 ] [ 2.403862 2.938822 1.215589 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.495841e-11 5.267621e-11 8.966685e-11 ] [ 1.884113e-11 6.23136e-11 2.979456e-10 ] [ 1.483282e-10 2.75051e-10 2.967402e-10 ] [ 1.97645e-10 1.30316e-10 2.052926e-10 ] [ 2.403862e-10 2.938822e-10 1.215589e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.8747707 -10.1680777 -17.8627703 ] [ -8.0333945 -2.5893605 7.77633 ] [ -11.3646601 19.3260583 22.2777909 ] [ 22.3225119 -21.3472212 3.8070305 ] [ 8.9503134 14.7786011 -15.9983811 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.902548014964782e-08 -1.629105650363646e-08 -2.861931319316917e-08 ] [ -1.287091695960411e-08 -4.148612890102557e-09 1.245905422427322e-08 ] [ -1.82081928655721e-08 3.096375903558176e-08 3.569295603711782e-08 ] [ 3.576460697836694e-08 -3.420201900746943e-08 6.099535312025337e-09 ] [ 1.43399829964571e-08 2.367792936562669e-08 -2.563223238024721e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 8.1356577 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.303476066916218e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3171131 -0.2661386 0.7976179 ] [ 0.4778386 0.9874695 2.9508374 ] [ 0.9031967 3.313761 3.2154284 ] [ 2.4495533 0.8874317 1.3940183 ] [ 2.7538876 3.2198666 1.7541396 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.171131e-11 -2.661386e-11 7.976179e-11 ] [ 4.778386e-11 9.874695e-11 2.9508374e-10 ] [ 9.031967e-11 3.313761e-10 3.2154284e-10 ] [ 2.4495533e-10 8.874317e-11 1.3940183e-10 ] [ 2.7538876e-10 3.2198666e-10 1.7541396e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.7e-06 6e-07 2.8e-06 ] [ 7.2e-06 7.6e-06 1.5e-06 ] [ -1.37e-05 5.3e-06 4e-06 ] [ -6e-07 -2.27e-05 -1.6e-05 ] [ 5.4e-06 9.2e-06 7.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.7237002778e-15 9.613059803999998e-16 4.486094575199999e-15 ] [ 1.15356717648e-14 1.21765424184e-14 2.403264951e-15 ] [ -2.19498198858e-14 8.4915361602e-15 6.408706535999999e-15 ] [ -9.613059803999998e-16 -3.636940959179999e-14 -2.5634826144e-14 ] [ 8.6517538236e-15 1.47400250328e-14 1.23367600818e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.146626 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.785886372513688e-18 } }