{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.019471000000001e-11 3.171987e-11 1.701209e-10 ] [ 3.1544706e-10 6.738803e-11 6.699442e-11 ] [ 2.3273024e-10 5.748949e-11 2.8697797e-10 ] [ 1.2276753e-10 1.9753574e-10 3.123934e-11 ] [ 1.8756934e-10 2.8365505e-10 2.4041323e-10 ] ] "source-value" [ [ 0.3019471 0.3171987 1.701209 ] [ 3.1544706 0.6738803 0.6699442 ] [ 2.3273024 0.5748949 2.8697797 ] [ 1.2276753 1.9753574 0.3123934 ] [ 1.8756934 2.8365505 2.4041323 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.373866452336e-12 1.3346131251264e-13 -2.37554727566016e-12 ] [ -1.01289605966976e-12 -8.7687126456384e-13 -1.44340091767872e-12 ] [ 9.757255620672e-13 -3.8676543626112e-13 4.66922332599744e-12 ] [ -1.02843717289152e-12 1.6750756570464e-12 9.3294744629184e-13 ] [ -3.0809856417984e-13 -5.450604863961601e-13 -1.7832225789504e-12 ] ] "source-value" [ [ 0.0008575 8.33e-05 -0.0014827 ] [ -0.0006322 -0.0005473 -0.0009009 ] [ 0.000609 -0.0002414 0.0029143 ] [ -0.0006419 0.0010455 0.0005823 ] [ -0.0001923 -0.0003402 -0.001113 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.397630320498095e-18 "source-value" -8.7233224 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.911928110262077e-09 -4.910485490263987e-09 -4.713114954524255e-10 ] [ 1.427011932589233e-09 -2.269489271634359e-09 -1.37888943625987e-09 ] [ 1.571500129563932e-08 -2.199201366713942e-08 1.431325969380165e-08 ] [ -4.608012168199777e-10 1.063536536776372e-09 -2.301479083068264e-08 ] [ -1.276928390114649e-08 2.810845189226139e-08 1.055173174815796e-08 ] ] "source-value" [ [ -2.4416335 -3.064884 -0.2941695 ] [ 0.8906708 -1.4165038 -0.8606351 ] [ 9.8085324 -13.7263354 8.9336341 ] [ -0.2876095 0.6638073 -14.3647027 ] [ -7.9699602 17.5439159 6.585873 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.25992263469412e-20 "source-value" 0.26588346 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.231689000000001e-11 1.640524e-11 1.493785e-10 ] [ 2.625554e-10 7.182531e-12 4.730882e-12 ] [ 2.391634e-10 1.372958e-10 2.83206e-10 ] [ 1.806242e-10 1.946446e-10 9.821647e-11 ] [ 1.54049e-10 2.8226e-10 2.60214e-10 ] ] "source-value" [ [ 0.5231689 0.1640524 1.493785 ] [ 2.625554 0.07182531 0.04730882 ] [ 2.391634 1.372958 2.83206 ] [ 1.806242 1.946446 0.9821647 ] [ 1.54049 2.8226 2.60214 ] ] } "instance-id" 1 }