{ "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" [ [ 1.63984 2.632724 3.733643 ] [ 2.059322 3.100925 1.548727 ] [ 0.4497259 4.960249 3.35449 ] [ 2.730005 4.489518 3.533282 ] [ 4.056337 2.434117 2.913545 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.63984e-10 2.632724e-10 3.733643e-10 ] [ 2.059322e-10 3.100925e-10 1.548727e-10 ] [ 4.497259e-11 4.960249e-10 3.35449e-10 ] [ 2.730005e-10 4.489518e-10 3.533282e-10 ] [ 4.056337e-10 2.434117e-10 2.913545e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1839336 -1.8976022 0.7841711 ] [ 0.5793155 0.3180606 -0.0147084 ] [ 0.1946933 -0.5819919 -0.1395608 ] [ 1.5993638 1.597705 -0.5109317 ] [ -1.189439 0.5638286 -0.1189703 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.896870734499579e-09 -3.040293880418646e-09 1.256380603127019e-09 ] [ 9.281657501670624e-10 5.095892573176206e-10 -2.356545460937472e-11 ] [ 3.119330534864007e-10 -9.324538156749715e-10 -2.236010509401447e-10 ] [ 2.562463288513847e-09 2.559805597935264e-09 -8.186028245655993e-10 ] [ -1.905691357667731e-09 9.03353001058395e-10 -1.906114332295623e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.644708775408901 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.44164381038474e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6059528 2.5636509 3.9400348 ] [ 1.9900078 3.3661323 1.5856996 ] [ 0.6654784 4.5387816 3.1145938 ] [ 2.9651721 4.6407357 3.5244621 ] [ 3.7086187 2.5082326 2.9188966 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6059528e-10 2.5636509e-10 3.9400348e-10 ] [ 1.9900078e-10 3.3661323e-10 1.5856996e-10 ] [ 6.654784e-11 4.5387816e-10 3.1145938e-10 ] [ 2.9651721e-10 4.6407357e-10 3.5244621e-10 ] [ 3.7086187e-10 2.5082326e-10 2.9188966e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.15e-05 2.4e-06 2.8e-06 ] [ 2.96e-05 -2.18e-05 6.3e-06 ] [ -3.66e-05 1.3e-05 -5.9e-06 ] [ 2.09e-05 -5.3e-06 1.75e-05 ] [ -3.54e-05 1.17e-05 -2.07e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.44467973472e-14 3.84522388992e-15 4.48609453824e-15 ] [ 4.742442797568e-14 -3.492745033344e-14 1.009371271104e-14 ] [ -5.863966432128e-14 2.08282960704e-14 -9.45284206272e-15 ] [ 3.348549137472e-14 -8.491536090240001e-15 2.8038090864e-14 ] [ -5.671705237632e-14 1.874546646336e-14 -3.316505605055999e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.7659997754089005 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.238150035698192e-19 } }