{ "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" [ [ 0.0780347 0.0112197 1.661349 ] [ 1.004167 1.583481 0.6099477 ] [ 1.186614 2.044688 2.371218 ] [ 2.525789 0.4216906 0.1723184 ] [ 2.89399 2.924329 1.948013 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.80347e-12 1.12197e-12 1.661349e-10 ] [ 1.004167e-10 1.583481e-10 6.099477e-11 ] [ 1.186614e-10 2.044688e-10 2.371218e-10 ] [ 2.525789e-10 4.216906e-11 1.723184e-11 ] [ 2.89399e-10 2.924329e-10 1.948013e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9539182 -4.4715204 1.2238325 ] [ -4.0034143 1.6872656 -10.133295 ] [ -2.7107678 2.7686109 11.0841072 ] [ 4.2933493 -2.5446702 -1.7750804 ] [ 5.374751 2.5603141 -0.3995643 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.732698679795618e-09 -7.164165444310264e-09 1.960795819275216e-09 ] [ -6.414176794836398e-09 2.703297497400084e-09 -1.623532834066954e-08 ] [ -4.343128793577451e-09 4.435803656072047e-09 1.775869741828095e-08 ] [ 6.878703873388045e-09 -4.077011102086461e-09 -2.843992316920313e-09 ] [ 8.611300394821421e-09 4.102075392924593e-09 -6.401725799663174e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -3.2118599 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.145966841065026e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4879743 0.2471347 1.4138966 ] [ 0.6227091 2.1631848 0.0553516 ] [ 1.1922631 1.8020547 3.0329223 ] [ 2.798176 0.2260143 0.9694357 ] [ 2.5874722 2.5470198 1.2912398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.879743e-11 2.471347e-11 1.4138966e-10 ] [ 6.227091e-11 2.1631848e-10 5.53516e-12 ] [ 1.1922631e-10 1.8020547e-10 3.0329223e-10 ] [ 2.798176e-10 2.260143e-11 9.694357000000001e-11 ] [ 2.5874722e-10 2.5470198e-10 1.2912398e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.52e-05 -3.2e-06 0.0 ] [ 2.1e-06 -5.1e-06 -1.47e-05 ] [ 4.5e-06 -6.9e-06 1.85e-05 ] [ 2.4e-06 -5.3e-06 -1.7e-06 ] [ 6.2e-06 2.04e-05 -2.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.435308463616e-14 -5.126965186560001e-15 0.0 ] [ 3.36457090368e-15 -8.17110076608e-15 -2.355199632576e-14 ] [ 7.2097947936e-15 -1.105501868352e-14 2.96402674848e-14 ] [ 3.84522388992e-15 -8.491536090240001e-15 -2.72370025536e-15 ] [ 9.93349504896e-15 3.268440306432e-14 -3.52478856576e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.7233245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397630656955185e-18 } }