{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.6618616 0.5532969 2.6678 ] [ 1.355444 2.726321 1.335983 ] [ 0.8455628 2.30582 2.977156 ] [ 2.930365 0.9373095 0.4139469 ] [ 2.829062 1.427351 2.413715 ] [ 2.781652 2.87748 1.992398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.618616000000001e-11 5.532969e-11 2.6678e-10 ] [ 1.355444e-10 2.726321e-10 1.335983e-10 ] [ 8.455628e-11 2.30582e-10 2.977156e-10 ] [ 2.930365e-10 9.373095e-11 4.139469e-11 ] [ 2.829062e-10 1.427351e-10 2.413715e-10 ] [ 2.781652e-10 2.87748e-10 1.992398e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.2369183 -21.5202019 -2.4083521 ] [ -43.0452027 7.0440234 -43.1662624 ] [ -16.8746083 14.7537853 27.358547 ] [ 0.8091884 -4.6066719 -8.6649907 ] [ 14.5577669 -63.3279834 25.7450367 ] [ 48.7897739 67.6570485 1.1360215 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.788291500427002e-09 -3.44791646431424e-08 -3.858605461064831e-09 ] [ -6.89660179717337e-08 1.128576970082924e-08 -6.915997699439276e-08 ] [ -2.703610312616246e-08 2.363817007071268e-08 4.383322474359079e-08 ] [ 1.296462746983846e-09 -7.380702078684384e-09 -1.38828456333673e-08 ] [ 2.332411397039861e-08 -1.014626152818199e-07 4.124809624221246e-08 ] [ 7.816983572072305e-08 1.083985422321047e-07 1.820107103021631e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 34.830323 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.580432966527278e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1021929 0.5076147 3.4934506 ] [ 1.4283382 3.1198395 0.9936677 ] [ -0.1447313 2.2256361 2.5047001 ] [ 2.4243547 1.1084233 0.0966577 ] [ 3.1612578 0.7321612 2.3677537 ] [ 3.4325351 3.1339036 2.3447691 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1021929e-10 5.076147e-11 3.4934506e-10 ] [ 1.4283382e-10 3.1198395e-10 9.936677000000001e-11 ] [ -1.447313e-11 2.2256361e-10 2.5047001e-10 ] [ 2.4243547e-10 1.1084233e-10 9.66577e-12 ] [ 3.1612578e-10 7.321612e-11 2.3677537e-10 ] [ 3.4325351e-10 3.1339036e-10 2.3447691e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.9e-06 9.2e-06 -2.5e-05 ] [ -1.58e-05 -9.9e-06 -9.2e-06 ] [ 6.8e-06 1.88e-05 2.91e-05 ] [ 1.71e-05 -2.8e-06 -3e-06 ] [ 2.1e-05 6.6e-06 5e-06 ] [ -2.03e-05 -2.19e-05 3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.42593720426e-14 1.47400250328e-14 -4.005441585e-14 ] [ -2.53143908172e-14 -1.58615486766e-14 -1.47400250328e-14 ] [ 1.08948011112e-14 3.012092071919999e-14 4.66233400494e-14 ] [ 2.73972204414e-14 -4.486094575199999e-15 -4.806529901999999e-15 ] [ 3.364570931399999e-14 1.05743657844e-14 8.010883169999999e-15 ] [ -3.252418567019999e-14 -3.50876682846e-14 4.9667475654e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.824992 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.375225578163692e-18 } }