{ "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" [ [ 1.256228 0.2353278 1.625271 ] [ 0.7175946 2.735818 1.079118 ] [ 2.902295 0.4260222 2.532348 ] [ 1.615511 1.481432 2.901286 ] [ 2.936652 2.941975 2.695922 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.256228e-10 2.353278e-11 1.625271e-10 ] [ 7.175946e-11 2.735818e-10 1.079118e-10 ] [ 2.902295e-10 4.260222e-11 2.532348e-10 ] [ 1.615511e-10 1.481432e-10 2.901286e-10 ] [ 2.936652e-10 2.941975e-10 2.695922e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.1039045 -14.2029456 -21.3170135 ] [ 2.5981054 -0.3753085 1.4184731 ] [ 34.7657648 -16.8771836 0.0024398 ] [ -25.3785401 24.6985409 23.1099054 ] [ 4.1185744 6.7568969 -3.2138048 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.580129950606745e-08 -2.275562757429311e-08 -3.415362093636256e-08 ] [ 4.162623764549223e-09 -6.01310509241589e-10 2.272644456777545e-09 ] [ 5.570089602569968e-08 -2.7040229211648e-08 3.9089905516332e-12 ] [ -4.066090395325202e-08 3.957142512387332e-08 3.702615044583042e-08 ] [ 6.598683669070569e-09 1.082574233152703e-08 -5.149082956797043e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.2515144 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.607323762794529e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.137818 0.230907 1.3096434 ] [ 0.9276266 2.6439018 1.1729871 ] [ 3.2110578 0.481426 2.5442767 ] [ 1.1509112 1.5699205 3.3994244 ] [ 3.000867 2.8944197 2.4076135 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.137818e-10 2.30907e-11 1.3096434e-10 ] [ 9.276266e-11 2.6439018e-10 1.1729871e-10 ] [ 3.2110578e-10 4.81426e-11 2.5442767e-10 ] [ 1.1509112e-10 1.5699205e-10 3.3994244e-10 ] [ 3.000867e-10 2.8944197e-10 2.4076135e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.8e-06 7.7e-06 6.2e-06 ] [ -6.8e-06 -9.8e-06 -2.6e-06 ] [ 7e-07 -3.9e-06 -1.11e-05 ] [ -1e-06 1.33e-05 -4e-06 ] [ -6e-07 -7.2e-06 1.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.24969777452e-14 1.23367600818e-14 9.9334951308e-15 ] [ -1.08948011112e-14 -1.57013310132e-14 -4.165659248399999e-15 ] [ 1.1215236438e-15 -6.248488872599999e-15 -1.77841606374e-14 ] [ -1.602176634e-15 2.13089492322e-14 -6.408706535999999e-15 ] [ -9.613059803999998e-16 -1.15356717648e-14 1.85852489544e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.867937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.221888462318406e-18 } }