{ "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" [ [ 1.047673 1.456203 2.59416 ] [ 0.648425 2.408552 0.8864435 ] [ 2.028254 0.9559849 0.3097335 ] [ 1.556479 0.0798405 1.221415 ] [ 2.621496 2.506538 1.825694 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.047673e-10 1.456203e-10 2.59416e-10 ] [ 6.48425e-11 2.408552e-10 8.864435000000001e-11 ] [ 2.028254e-10 9.559849e-11 3.097335e-11 ] [ 1.556479e-10 7.98405e-12 1.221415e-10 ] [ 2.621496e-10 2.506538e-10 1.825694e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.5087438 -2.4661593 24.9096206 ] [ -15.6208121 14.224025 -11.3517156 ] [ 38.9494632 51.6361321 -72.1983621 ] [ -30.7138384 -75.5616164 55.5361264 ] [ 16.8939312 12.1676186 3.1043308 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.523468700953695e-08 -3.951222773628494e-09 3.990961175831807e-08 ] [ -2.502729994452975e-08 2.278940030867472e-08 -1.818745334029064e-08 ] [ 6.240391933174995e-08 8.27302036391604e-08 -1.156745278166728e-07 ] [ -4.920899381950928e-08 -1.210630552259379e-07 8.897868332787368e-08 ] [ 2.706706160204369e-08 1.949467405173123e-08 4.973686230989361e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 33.303688 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.335839030001751e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9473823 1.3259084 2.7470479 ] [ 0.4644342 2.8528593 0.7433861 ] [ 2.1858988 1.0935404 0.0216971 ] [ 1.4712677 -0.6646944 1.5008468 ] [ 2.833344 2.7995048 1.8244681 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.473823e-11 1.3259084e-10 2.7470479e-10 ] [ 4.644342000000001e-11 2.8528593e-10 7.433861000000001e-11 ] [ 2.1858988e-10 1.0935404e-10 2.16971e-12 ] [ 1.4712677e-10 -6.646944e-11 1.5008468e-10 ] [ 2.833344e-10 2.7995048e-10 1.8244681e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.08e-05 1.58e-05 -9.7e-06 ] [ 9.8e-06 -7.6e-06 5.4e-06 ] [ -3e-07 1.34e-05 5.7e-06 ] [ -4e-07 -5.1e-06 1.3e-06 ] [ -1.99e-05 -1.64e-05 -2.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.730350750464e-14 2.531439060864e-14 -1.554111322176e-14 ] [ 1.570133088384e-14 -1.217654231808e-14 8.65175375232e-15 ] [ -4.8065298624e-16 2.146916671872e-14 9.13240673856e-15 ] [ -6.408706483200001e-16 -8.17110076608e-15 2.08282960704e-15 ] [ -3.188331475392e-14 -2.627569658112e-14 -4.32587687616e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.744302 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.721426947121468e-18 } }