{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.851893 1.689536 1.360291 ] [ 1.367517 2.93292 5.4803 ] [ 1.756353 1.339195 3.328571 ] [ 1.204701 3.536746 3.011508 ] [ 3.888723 1.68848 3.240915 ] [ 3.83892 3.544284 1.733331 ] [ 3.269318 3.65155 3.991072 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.851893e-10 1.689536e-10 1.360291e-10 ] [ 1.367517e-10 2.93292e-10 5.4803e-10 ] [ 1.756353e-10 1.339195e-10 3.328571e-10 ] [ 1.204701e-10 3.536746e-10 3.011508e-10 ] [ 3.888723e-10 1.68848e-10 3.240915e-10 ] [ 3.83892e-10 3.544284e-10 1.733331e-10 ] [ 3.269318e-10 3.65155e-10 3.991072e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.7457546 -10.5945669 -21.7593145 ] [ -0.0878515 -0.5611254 1.2069924 ] [ -16.1927697 -10.3663877 5.9908223 ] [ -7.0771008 5.2420605 -3.9479668 ] [ 22.5350709 -10.5117758 13.5624899 ] [ 6.5744927 15.1992724 -5.0127282 ] [ 3.9939131 11.5925229 9.959705 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.561442017217406e-08 -1.697436739468153e-08 -3.486226497653444e-08 ] [ -1.407536194022112e-10 -8.990219972170483e-10 1.933815004763282e-09 ] [ -2.594367703933863e-08 -1.660878401508868e-08 9.598355428427283e-09 ] [ -1.133876544480498e-08 8.398706777919158e-09 -6.32534010665459e-09 ] [ 3.610516374405042e-08 -1.684172142985122e-08 2.172950423761613e-08 ] [ 1.053349849756027e-08 2.43519188924507e-08 -8.031275928464866e-09 ] [ 6.398954194326852e-09 1.857326916646862e-08 1.595720650106486e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.3892137 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.344100205703507e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2388401 1.6837696 1.4765299 ] [ 1.316465 3.0469063 4.6917244 ] [ 1.9159275 0.8115859 3.8341646 ] [ 1.1147724 3.782906 2.3445868 ] [ 4.2501373 1.5639789 3.1948064 ] [ 3.6296349 3.8652998 2.0410861 ] [ 3.7116478 3.6282646 4.5630897 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2388401e-10 1.6837696e-10 1.4765299e-10 ] [ 1.316465e-10 3.0469063e-10 4.691724400000001e-10 ] [ 1.9159275e-10 8.115859e-11 3.8341646e-10 ] [ 1.1147724e-10 3.782906e-10 2.3445868e-10 ] [ 4.2501373e-10 1.5639789e-10 3.1948064e-10 ] [ 3.6296349e-10 3.8652998e-10 2.0410861e-10 ] [ 3.7116478e-10 3.6282646e-10 4.5630897e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.48e-05 -1.81e-05 -1.91e-05 ] [ -5.8e-06 1.71e-05 -1.49e-05 ] [ -1.45e-05 -2.27e-05 2.3e-05 ] [ -1.51e-05 2.5e-05 -1.04e-05 ] [ 3.79e-05 5.34e-05 7e-07 ] [ -4.3e-06 -1.47e-05 2.22e-05 ] [ 1.67e-05 -3.99e-05 -1.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.371221398784e-14 -2.899939683648e-14 -3.060157345728e-14 ] [ -9.292624400640001e-15 2.739722021568e-14 -2.387243164992e-14 ] [ -2.32315610016e-14 -3.636940929216e-14 3.68500622784e-14 ] [ -2.419286697408e-14 4.005441552e-14 -1.666263685632e-14 ] [ 6.072249392832e-14 8.555623155072e-14 1.12152363456e-15 ] [ -6.889359469440001e-15 -2.355199632576e-14 3.556832098176e-14 ] [ 2.675634956736e-14 -6.392684716992e-14 -2.4032649312e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759033381772e-18 } }