{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.3770021 2.480989 0.330891 ] [ 1.37199 1.592611 1.860343 ] [ 2.331643 1.562489 0.0391846 ] [ 2.732161 1.633533 2.725687 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.770021e-11 2.480989e-10 3.30891e-11 ] [ 1.37199e-10 1.592611e-10 1.860343e-10 ] [ 2.331643e-10 1.562489e-10 3.91846e-12 ] [ 2.732161e-10 1.633533e-10 2.725687e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.7116124 3.5374045 -3.6210118 ] [ -38.4460612 -3.724045 -14.4454691 ] [ 5.7241508 -1.0974552 -2.4920416 ] [ 37.4335228 1.2840957 20.5585225 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.548835295744661e-09 5.667546834906453e-09 -5.80150049739828e-09 ] [ -6.1597380923974e-08 -5.96657788296453e-09 -2.314419305918901e-08 ] [ 9.171100661252406e-09 -1.758317078301797e-09 -3.992690822475974e-09 ] [ 5.997511555846624e-08 2.057348126359873e-09 3.293838437906325e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.8697587 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.393507066358216e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9569172 2.8910023 0.692916 ] [ 0.8253063 0.9133347 1.8869018 ] [ 2.3919277 1.144115 0.1997405 ] [ 2.6386449 2.3211701 2.1765473 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.569172e-11 2.8910023e-10 6.929160000000001e-11 ] [ 8.253063000000001e-11 9.133347000000001e-11 1.8869018e-10 ] [ 2.3919277e-10 1.144115e-10 1.997405e-11 ] [ 2.6386449e-10 2.3211701e-10 2.1765473e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.51e-05 7.7e-06 -2.15e-05 ] [ -2.82e-05 -3.5e-06 2.94e-05 ] [ 2.81e-05 4.7e-06 -2.88e-05 ] [ 2.52e-05 -8.9e-06 2.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.02146335134e-14 1.23367600818e-14 -3.4446797631e-14 ] [ -4.51813810788e-14 -5.607618218999999e-15 4.710399303959999e-14 ] [ 4.50211634154e-14 7.530230179799999e-15 -4.614268705919999e-14 ] [ 4.037485117679999e-14 -1.42593720426e-14 3.332527398719999e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.70586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.516356190887524e-18 } }