{ "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" [ [ 1.593193 1.569284 2.84459 ] [ 1.603337 4.216737 3.188357 ] [ 3.675145 1.205287 1.773064 ] [ 3.545696 2.526378 4.008338 ] [ 3.206595 3.44318 2.117333 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.593193e-10 1.569284e-10 2.84459e-10 ] [ 1.603337e-10 4.216737e-10 3.188357e-10 ] [ 3.675145e-10 1.205287e-10 1.773064e-10 ] [ 3.545696e-10 2.526378e-10 4.008338e-10 ] [ 3.206595e-10 3.44318e-10 2.117333e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4990546 -0.5664368 0.3278337 ] [ -2.261555 0.6090258 1.1587353 ] [ 0.4481737 -1.172376 -0.6480413 ] [ 1.0154441 -0.773938 2.7834149 ] [ 2.2969919 1.903725 -3.6219427 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.401750253210216e-09 -9.07531805597731e-10 5.252474939777658e-10 ] [ -3.623410577505869e-09 9.757669062631571e-10 1.85649862265098e-09 ] [ 7.180534301133257e-10 -1.878353433462384e-09 -1.038276628726984e-09 ] [ 1.626920810153159e-09 -1.239985379764692e-09 4.459522315507447e-09 ] [ 3.680186750667264e-09 3.05010371256165e-09 -5.802991963626872e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.413653132689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.508233508977629e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6909963 1.5337616 3.3422172 ] [ 1.4120867 3.7872152 2.6203986 ] [ 3.1133748 1.5008154 1.4310482 ] [ 3.6489051 2.4885023 4.3075636 ] [ 3.758603 3.6505715 2.2304544 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6909963e-10 1.5337616e-10 3.3422172e-10 ] [ 1.4120867e-10 3.7872152e-10 2.6203986e-10 ] [ 3.1133748e-10 1.5008154e-10 1.4310482e-10 ] [ 3.6489051e-10 2.4885023e-10 4.3075636e-10 ] [ 3.758603e-10 3.6505715e-10 2.2304544e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.9e-05 -1.9e-05 4.08e-05 ] [ -6.44e-05 5.33e-05 -1.95e-05 ] [ 6.18e-05 -6.51e-05 -3.09e-05 ] [ 7.22e-05 -6.04e-05 4.41e-05 ] [ 1.94e-05 9.12e-05 -3.45e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.42593720426e-13 -3.0441356046e-14 6.53688066672e-14 ] [ -1.031801752296e-13 8.53960145922e-14 -3.1242444363e-14 ] [ 9.901451598119999e-14 -1.043016988734e-13 -4.950725799059999e-14 ] [ 1.156771529748e-13 -9.677146869359998e-14 7.06559895594e-14 ] [ 3.10822266996e-14 1.461185090208e-13 -5.527509387299999e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }