{ "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" [ [ 0.6618616 0.5532969 2.6678 ] [ 1.355444 2.726321 1.335983 ] [ 0.8455628 2.30582 2.977156 ] [ 2.930365 0.9373095 0.4139469 ] [ 2.829062 1.427351 2.413715 ] [ 2.781652 2.87748 1.992398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.618616000000001e-11 5.532969e-11 2.6678e-10 ] [ 1.355444e-10 2.726321e-10 1.335983e-10 ] [ 8.455628e-11 2.30582e-10 2.977156e-10 ] [ 2.930365e-10 9.373095e-11 4.139469e-11 ] [ 2.829062e-10 1.427351e-10 2.413715e-10 ] [ 2.781652e-10 2.87748e-10 1.992398e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.0120142 -32.0472292 2.4859932 ] [ -39.8859052 15.7121409 -52.796722 ] [ -14.6971078 16.7154944 32.2362877 ] [ 2.7573423 -5.0035397 -11.1309481 ] [ 12.5299357 -60.8592126 26.6262147 ] [ 47.3077492 65.4823462 2.5791744 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.28366619425162e-08 -5.134532180868251e-08 3.983000217322888e-09 ] [ -6.39042653373791e-08 2.517362502009572e-08 -8.458967434019374e-08 ] [ -2.354736270453914e-08 2.678117455343785e-08 5.16482269198416e-08 ] [ 4.417749404999818e-09 -8.01655439463137e-09 -1.783374496008669e-08 ] [ 2.007517020406243e-08 -9.750720839135838e-08 4.265989904420731e-08 ] [ 7.57953703753722e-08 1.049142850211387e-07 4.132292958690969e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 37.819536 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.059357688792182e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0931513 0.5049522 3.4866355 ] [ 1.4351516 3.1233489 0.9950597 ] [ -0.1463872 2.2280091 2.4971832 ] [ 2.4310062 1.1124291 0.0970834 ] [ 3.1577336 0.7288238 2.3700984 ] [ 3.4332919 3.1300155 2.3549387 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0931513e-10 5.049522e-11 3.486635500000001e-10 ] [ 1.4351516e-10 3.1233489e-10 9.950597e-11 ] [ -1.463872e-11 2.2280091e-10 2.4971832e-10 ] [ 2.4310062e-10 1.1124291e-10 9.708340000000001e-12 ] [ 3.1577336e-10 7.288238e-11 2.3700984e-10 ] [ 3.4332919e-10 3.1300155e-10 2.3549387e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.6e-06 -5.1e-06 2.5e-06 ] [ -7.1e-06 -2.4e-06 -4.3e-06 ] [ -2.4e-06 6e-06 -4.6e-06 ] [ -1.8e-06 2.4e-06 -3.2e-06 ] [ -2.1e-06 -2.6e-06 4.6e-06 ] [ 6.9e-06 1.7e-06 4.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.05743657844e-14 -8.1711008334e-15 4.005441585e-15 ] [ -1.13754541014e-14 -3.845223921599999e-15 -6.8893595262e-15 ] [ -3.845223921599999e-15 9.613059803999999e-15 -7.370012516399999e-15 ] [ -2.8839179412e-15 3.845223921599999e-15 -5.1269652288e-15 ] [ -3.364570931399999e-15 -4.165659248399999e-15 7.370012516399999e-15 ] [ 1.10550187746e-14 2.7237002778e-15 7.850665506599998e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.821782 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.374711279464179e-18 } }