{ "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" [ [ 1.480644 1.446872 2.305559 ] [ 2.063952 3.613106 1.277693 ] [ 1.847715 3.513174 3.941338 ] [ 3.676983 1.999062 1.431631 ] [ 3.525184 1.303022 4.049537 ] [ 4.005288 3.245475 3.233925 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.480644e-10 1.446872e-10 2.305559e-10 ] [ 2.063952e-10 3.613106000000001e-10 1.277693e-10 ] [ 1.847715e-10 3.513174e-10 3.941338e-10 ] [ 3.676983e-10 1.999062e-10 1.431631e-10 ] [ 3.525184e-10 1.303022e-10 4.049537e-10 ] [ 4.005288e-10 3.245475e-10 3.233925e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.65314 0.1404061 3.5898831 ] [ 0.811685 1.8277913 3.648068 ] [ -0.208621 -2.9073137 -2.3395354 ] [ 2.4304451 -2.9146053 -1.0832941 ] [ -3.7954449 -0.175295 -1.9249323 ] [ 0.1087958 4.0290166 -1.8901893 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.046445638109312e-09 2.249553708377069e-10 5.751626774225029e-09 ] [ 1.300462730454048e-09 2.928444488561639e-09 5.844849260688615e-09 ] [ -3.342476888079168e-10 -4.658030039471545e-09 -3.748348921413977e-09 ] [ 3.894002317357918e-09 -4.669712470519769e-09 -1.735628480470577e-09 ] [ -6.080973084314594e-09 -2.80853550743136e-10 -3.084081527682772e-09 ] [ 1.743100872012326e-10 6.455196201335106e-09 -3.028417105346318e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.15621 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.069163180513517e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.401844 1.4219314 2.3254683 ] [ 2.1640213 3.6911617 1.4902879 ] [ 1.7725683 3.31797 3.9672504 ] [ 3.7606871 1.7222674 1.4459771 ] [ 3.3692339 1.3490751 3.9229396 ] [ 4.1314114 3.6183054 3.0877596 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.401844e-10 1.4219314e-10 2.3254683e-10 ] [ 2.1640213e-10 3.6911617e-10 1.4902879e-10 ] [ 1.7725683e-10 3.31797e-10 3.9672504e-10 ] [ 3.7606871e-10 1.7222674e-10 1.4459771e-10 ] [ 3.3692339e-10 1.3490751e-10 3.9229396e-10 ] [ 4.1314114e-10 3.6183054e-10 3.0877596e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.5e-06 -4.4e-06 -2.4e-06 ] [ 9e-07 5e-07 1.8e-06 ] [ 1e-07 -1.7e-06 -1e-06 ] [ -7e-07 -1.1e-06 2.4e-06 ] [ 4e-07 9e-07 -1.1e-06 ] [ 5.9e-06 5.8e-06 2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.04141480352e-14 -7.04957713152e-15 -3.84522388992e-15 ] [ 1.44195895872e-15 8.010883104e-16 2.88391791744e-15 ] [ 1.6021766208e-16 -2.72370025536e-15 -1.6021766208e-15 ] [ -1.12152363456e-15 -1.76239428288e-15 3.84522388992e-15 ] [ 6.408706483200001e-16 1.44195895872e-15 -1.76239428288e-15 ] [ 9.45284206272e-15 9.292624400640001e-15 3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -21.869792 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.503926944415888e-18 } }