{ "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" [ [ 2.3631785 3.6034995 -2.1424866 ] [ -2.7417084 -1.6798394 2.3193651 ] [ -0.1392853 0.8280676 3.8182191 ] [ 0.5178152 -2.7517278 -3.9950976 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.786229374671169e-09 5.773442699530682e-09 -3.432641969178104e-09 ] [ -4.392701135721525e-09 -2.691399435552579e-09 3.716032568935073e-09 ] [ -2.231596531196802e-10 1.326710560092458e-09 6.117461425512509e-09 ] [ 8.296314141700368e-10 -4.408753984288225e-09 -6.400852025269478e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.5162542 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.83801358644436e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.2798411 3.2154305 2.9749909 ] [ 2.3022042 3.5107567 0.8459298 ] [ 4.4513781 3.330848 1.8529284 ] [ 3.4290115 3.0355448 3.9819899 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2798411e-10 3.2154305e-10 2.9749909e-10 ] [ 2.3022042e-10 3.5107567e-10 8.459298e-11 ] [ 4.4513781e-10 3.330848e-10 1.8529284e-10 ] [ 3.4290115e-10 3.0355448e-10 3.9819899e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.4e-06 9.8e-06 -3.8e-06 ] [ 1.68e-05 -6.9e-06 -1.78e-05 ] [ -3.14e-05 1.19e-05 -1.52e-05 ] [ 1.32e-05 -1.48e-05 3.67e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.2430472876e-15 1.57013310132e-14 -6.088271209199999e-15 ] [ 2.691656745119999e-14 -1.10550187746e-14 -2.851874408519999e-14 ] [ -5.030834630759999e-14 1.90659019446e-14 -2.43530848368e-14 ] [ 2.11487315688e-14 -2.37122141832e-14 5.879988246779999e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.6361973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.383671352067389e-18 } }