{ "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" [ [ 0.2609343 1.090408 2.782185 ] [ 0.9561081 2.831858 1.606096 ] [ 1.573969 0.2926919 1.087299 ] [ 2.9831 1.515461 0.0011433 ] [ 2.828068 2.074027 2.745594 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.609343e-11 1.090408e-10 2.782185e-10 ] [ 9.561081000000001e-11 2.831858e-10 1.606096e-10 ] [ 1.573969e-10 2.926919e-11 1.087299e-10 ] [ 2.9831e-10 1.515461e-10 1.1433e-13 ] [ 2.828068e-10 2.074027e-10 2.745594e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.272355 -0.8220536 1.3506897 ] [ -0.287902 1.9926946 -1.1919832 ] [ -0.9014585 -2.6946936 0.050563 ] [ 1.1461275 1.5445435 -0.4491455 ] [ 1.315588 -0.020491 0.239876 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.038537434357984e-09 -1.317075058964475e-09 2.164043459295366e-09 ] [ -4.612698534815616e-10 3.192648700514408e-09 -1.909767615426371e-09 ] [ -1.444295733321437e-09 -4.317375086139386e-09 8.10108564775104e-11 ] [ 1.836298684955952e-09 2.474631485508605e-09 -7.196104194375264e-10 ] [ 2.107804336205031e-09 -3.28302011368128e-11 3.843237190910208e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.0487865 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.449775417691066e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6261857 1.1038033 2.7344369 ] [ 0.9424213 3.128265 1.320031 ] [ 1.3849496 -0.2200176 0.8977102 ] [ 2.7505739 1.6775406 0.4117551 ] [ 2.8980489 2.1148546 2.8583841 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.261857e-11 1.1038033e-10 2.7344369e-10 ] [ 9.424213e-11 3.128265e-10 1.320031e-10 ] [ 1.3849496e-10 -2.200176e-11 8.977102000000001e-11 ] [ 2.7505739e-10 1.6775406e-10 4.117551e-11 ] [ 2.8980489e-10 2.1148546e-10 2.8583841e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.18e-05 7.2e-06 4.3e-06 ] [ -6.1e-06 2.8e-06 2.4e-06 ] [ 1.65e-05 -1e-07 -1.7e-06 ] [ -3.4e-06 -3e-06 -9e-07 ] [ 1.49e-05 -6.9e-06 -4.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.492745033344e-14 1.153567166976e-14 6.889359469440001e-15 ] [ -9.77327738688e-15 4.48609453824e-15 3.84522388992e-15 ] [ 2.64359142432e-14 -1.6021766208e-16 -2.72370025536e-15 ] [ -5.44740051072e-15 -4.8065298624e-15 -1.44195895872e-15 ] [ 2.387243164992e-14 -1.105501868352e-14 -6.72914180736e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.393797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.665269855474118e-18 } }