{ "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" [ [ 0.049795 0.7119441 0.3423404 ] [ 0.1447331 1.623908 1.772641 ] [ 2.54973 0.1092944 1.824085 ] [ 1.77811 2.382187 0.8238028 ] [ 2.019176 2.140924 2.983896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.9795e-12 7.119441e-11 3.423404e-11 ] [ 1.447331e-11 1.623908e-10 1.772641e-10 ] [ 2.54973e-10 1.092944e-11 1.824085e-10 ] [ 1.77811e-10 2.382187e-10 8.238028e-11 ] [ 2.019176e-10 2.140924e-10 2.983896e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.6069653 -11.2263751 -15.6178907 ] [ -15.1744734 4.487332 12.0267786 ] [ 8.8388831 -12.050407 0.724185 ] [ 8.9246701 12.2949244 -12.3953385 ] [ 6.0178855 6.4945257 15.2622656 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.378987857969686e-08 -1.798663572155126e-08 -2.502261934574975e-08 ] [ -2.431218651443149e-08 7.189498420167706e-09 1.926902349645775e-08 ] [ 1.416145185680423e-08 -1.930688036652467e-08 1.160272276134048e-09 ] [ 1.42988977825728e-08 1.969864042818347e-08 -1.985952155160214e-08 ] [ 9.641715454751318e-09 1.040537723972475e-08 2.445284512476008e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 56.065109 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.982620688240367e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.7520911 -0.6044421 -1.5682745 ] [ -1.9453307 2.1698606 3.0284008 ] [ 3.5223919 -1.395509 1.8261023 ] [ 2.6054398 3.6977919 -0.5213151 ] [ 3.1111341 3.1005561 4.9818516 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.520911000000001e-11 -6.044421e-11 -1.5682745e-10 ] [ -1.9453307e-10 2.1698606e-10 3.0284008e-10 ] [ 3.5223919e-10 -1.395509e-10 1.8261023e-10 ] [ 2.6054398e-10 3.6977919e-10 -5.213151e-11 ] [ 3.1111341e-10 3.1005561e-10 4.9818516e-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 ] [ 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 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" -1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.846037335159101e-34 } }