{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.568329 2.374036 2.84115 ] [ 2.585215 4.223663 1.237778 ] [ 4.050363 2.582934 1.712612 ] [ 3.258528 3.911947 3.864299 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.568329e-10 2.374036e-10 2.84115e-10 ] [ 2.585215e-10 4.223663e-10 1.237778e-10 ] [ 4.050363e-10 2.582934e-10 1.712612e-10 ] [ 3.258528e-10 3.911947e-10 3.864299e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.4447558 -1.4706858 1.0137477 ] [ -1.2570655 2.4933383 -2.6534204 ] [ 3.097924 -1.9652659 -1.1818767 ] [ 0.6038974 0.9426133 2.8215495 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.9169305863252e-09 -2.356298405302545e-09 1.624202864329772e-09 ] [ -2.014040954914262e-09 3.994768332005217e-09 -4.251248130033784e-09 ] [ 4.963421405815219e-09 -3.148703078635471e-09 -1.893575217408255e-09 ] [ 9.67550295641906e-10 1.510232991715137e-09 4.52062064332993e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.4523838 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.531328610388663e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.2764675 3.2256577 2.9770017 ] [ 2.301889 3.5212521 0.8438311 ] [ 4.45475 3.3206323 1.8509178 ] [ 3.4293285 3.0250379 3.9840884 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2764675e-10 3.2256577e-10 2.9770017e-10 ] [ 2.301889e-10 3.5212521e-10 8.438311e-11 ] [ 4.45475e-10 3.320632300000001e-10 1.8509178e-10 ] [ 3.4293285e-10 3.0250379e-10 3.9840884e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 -0.0 ] [ 0.0 -0.0 0.0 ] [ -0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" -5.5109562 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.82952518189281e-19 } }