{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1854996 0.4736791 1.206297 ] [ 0.6742688 0.1009159 2.297624 ] [ 0.6067687 1.83215 2.754335 ] [ 0.1838578 2.712055 1.507331 ] [ 1.981528 1.354685 0.3328332 ] [ 2.901733 2.736996 1.329123 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.854996e-11 4.736791e-11 1.206297e-10 ] [ 6.742688e-11 1.009159e-11 2.297624e-10 ] [ 6.067687000000001e-11 1.83215e-10 2.754335e-10 ] [ 1.838578e-11 2.712055e-10 1.507331e-10 ] [ 1.981528e-10 1.354685e-10 3.328332e-11 ] [ 2.901733e-10 2.736996e-10 1.329123e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -111.017193 76.4393075 -260.5209428 ] [ 107.2326554 -92.5098218 237.6120399 ] [ 30.9496687 -25.1222667 106.13751 ] [ -28.6679686 42.3699669 -80.6165553 ] [ -12.5269425 -19.21956 -16.392935 ] [ 14.0297801 18.0423742 13.7808832 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.778691525968684e-07 1.224692723956409e-07 -4.174005672218105e-07 ] [ 1.718056548836539e-07 -1.482170749034638e-07 3.806964582848557e-07 ] [ 4.958683602118115e-08 -4.025030869985629e-08 1.700510385129413e-07 ] [ -4.593114943516569e-08 6.788417095053341e-08 -1.291619612152288e-07 ] [ -2.007037456896154e-08 -3.079312994776103e-08 -2.626437741968079e-08 ] [ 2.247818585637818e-08 2.890707036512444e-08 2.207940905892315e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 104.05366 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.667123427341804e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.0652336 0.5830896 0.5438388 ] [ 0.6663712 -0.2013972 2.8652605 ] [ 1.0643365 2.2748321 3.140333 ] [ -0.6946047 2.8249042 1.4171644 ] [ 2.3240865 1.200598 -0.2884796 ] [ 3.1082327 2.5284543 1.7494261 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.523360000000001e-12 5.830896e-11 5.438387999999999e-11 ] [ 6.663712000000001e-11 -2.013972e-11 2.8652605e-10 ] [ 1.0643365e-10 2.2748321e-10 3.140333e-10 ] [ -6.946047e-11 2.8249042e-10 1.4171644e-10 ] [ 2.3240865e-10 1.200598e-10 -2.884796e-11 ] [ 3.1082327e-10 2.5284543e-10 1.7494261e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.06e-05 -3.2e-06 2.68e-05 ] [ -2.06e-05 -6e-07 -2.03e-05 ] [ -6.4e-06 1.51e-05 2.8e-06 ] [ 2.63e-05 -1.8e-05 -1.13e-05 ] [ -5.38e-05 1.31e-05 -3.2e-06 ] [ 3.9e-06 -6.3e-06 5.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.107013768039999e-14 -5.1269652288e-15 4.293833379119999e-14 ] [ -3.300483866039999e-14 -9.613059803999998e-16 -3.252418567019999e-14 ] [ -1.02539304576e-14 2.41928671734e-14 4.486094575199999e-15 ] [ 4.21372454742e-14 -2.8839179412e-14 -1.81045959642e-14 ] [ -8.619710290919999e-14 2.09885139054e-14 -5.1269652288e-15 ] [ 6.248488872599999e-15 -1.00937127942e-14 8.331318496799998e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.273917 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.767586619505538e-18 } }