{ "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" [ [ 2.91343 2.805447 1.311156 ] [ 2.653002 2.505168 3.277079 ] [ 1.829519 4.618852 2.376516 ] [ 4.982305 1.900488 2.423676 ] [ 4.143762 3.996307 2.985709 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.91343e-10 2.805447e-10 1.311156e-10 ] [ 2.653002e-10 2.505168e-10 3.277079e-10 ] [ 1.829519e-10 4.618852000000001e-10 2.376516e-10 ] [ 4.982305e-10 1.900488e-10 2.423676e-10 ] [ 4.143762e-10 3.996307e-10 2.985709e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0952243 -1.7330052 -14.3036808 ] [ -6.5824379 -7.8503276 12.3996255 ] [ -3.0859773 4.0036758 0.0296778 ] [ 2.7853775 -2.8617798 -0.582813 ] [ 6.9782621 8.4414367 2.4571905 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.525661471920454e-10 -2.776580415164828e-09 -2.291702296914584e-08 ] [ -1.054622811124785e-08 -1.257761134634097e-08 1.986639008277551e-08 ] [ -4.944280682379508e-09 6.414595764022737e-09 4.754907731677824e-11 ] [ 4.462666710602352e-09 -4.585076689437699e-09 -9.337693628983104e-10 ] [ 1.118040839043471e-08 1.35246725267031e-08 3.936853171951862e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.5874328 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.349877581651083e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.6641342 2.4509998 0.914739 ] [ 2.5460073 2.3291051 3.5627813 ] [ 2.1662956 4.5732683 2.1988143 ] [ 4.8216978 2.1752972 2.2068867 ] [ 4.3238831 4.2975915 3.4909147 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6641342e-10 2.4509998e-10 9.14739e-11 ] [ 2.5460073e-10 2.3291051e-10 3.5627813e-10 ] [ 2.1662956e-10 4.5732683e-10 2.1988143e-10 ] [ 4.821697800000001e-10 2.1752972e-10 2.2068867e-10 ] [ 4.3238831e-10 4.297591500000001e-10 3.4909147e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.26e-05 -1.1e-05 3.78e-05 ] [ 1.04e-05 1.2e-06 -1.25e-05 ] [ 2.2e-06 1.39e-05 -1.75e-05 ] [ -1.11e-05 -1.14e-05 -3.54e-05 ] [ -1.41e-05 7.2e-06 2.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.018742542208e-14 -1.76239428288e-14 6.056227626623999e-14 ] [ 1.666263685632e-14 1.92261194496e-15 -2.002720776e-14 ] [ 3.52478856576e-15 2.227025502912e-14 -2.8038090864e-14 ] [ -1.778416049088e-14 -1.826481347712e-14 -5.671705237632e-14 ] [ -2.259069035328e-14 1.153567166976e-14 4.422007473408001e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.344147 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.657315048551846e-18 } }