{ "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" [ [ 2.990348 2.100415 1.411886 ] [ 2.946969 3.752547 2.888488 ] [ 5.496135 2.06422 2.457996 ] [ 4.937229 4.674633 2.559339 ] [ 4.468449 3.37128 4.359326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.990348e-10 2.100415e-10 1.411886e-10 ] [ 2.946969e-10 3.752547e-10 2.888488e-10 ] [ 5.496135e-10 2.06422e-10 2.457996e-10 ] [ 4.937229e-10 4.674633e-10 2.559339e-10 ] [ 4.468449e-10 3.37128e-10 4.359326000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.0881291 -2.0103514 0.0210067 ] [ -5.2800564 1.7887266 -0.488669 ] [ -4.326272 1.5780814 -1.1239833 ] [ 2.8823115 0.7061566 -1.7134012 ] [ 2.6358878 -2.0626131 3.3050468 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.549904866832145e-09 -3.220938012672549e-09 3.365644362015936e-11 ] [ -8.459582920585414e-09 2.865855939523073e-09 -7.829340471097152e-10 ] [ -6.931451853621658e-09 2.528365124799333e-09 -1.800819765429633e-09 ] [ 4.61797209916298e-09 1.131387595143617e-09 -2.745171344690665e-09 ] [ 4.223157808211946e-09 -3.304670486575812e-09 5.295268713609853e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.525289 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.006772520456341e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1839293 2.0076409 1.5595868 ] [ 2.7657398 3.915753 2.8627385 ] [ 5.3744875 2.2341195 2.3745348 ] [ 5.0385507 4.6156604 2.4864702 ] [ 4.4764228 3.1899213 4.3937046 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1839293e-10 2.0076409e-10 1.5595868e-10 ] [ 2.7657398e-10 3.915753e-10 2.8627385e-10 ] [ 5.374487500000001e-10 2.2341195e-10 2.3745348e-10 ] [ 5.0385507e-10 4.6156604e-10 2.4864702e-10 ] [ 4.4764228e-10 3.1899213e-10 4.3937046e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-06 -2.2e-06 4.8e-06 ] [ -1.28e-05 -9e-07 -1e-06 ] [ 5.4e-06 -8.1e-06 -4.5e-06 ] [ 1.04e-05 1e-05 5e-06 ] [ -1.1e-06 1.3e-06 -4.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-15 -3.52478856576e-15 7.69044777984e-15 ] [ -2.050786074624e-14 -1.44195895872e-15 -1.6021766208e-15 ] [ 8.65175375232e-15 -1.297763062848e-14 -7.2097947936e-15 ] [ 1.666263685632e-14 1.6021766208e-14 8.010883104e-15 ] [ -1.76239428288e-15 2.08282960704e-15 -6.889359469440001e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.214602 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.277430299837692e-18 } }