{ "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" [ [ 1.302275 0.3737398 2.647818 ] [ 0.2826825 1.480501 1.727575 ] [ 0.6414777 2.53008 2.452953 ] [ 2.763361 0.4669357 0.177905 ] [ 2.062003 2.101671 0.3497139 ] [ 2.601995 2.989286 1.853157 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.302275e-10 3.737398e-11 2.647818e-10 ] [ 2.826825e-11 1.480501e-10 1.727575e-10 ] [ 6.414777000000001e-11 2.53008e-10 2.452953e-10 ] [ 2.763361e-10 4.669357e-11 1.77905e-11 ] [ 2.062003e-10 2.101671e-10 3.497139e-11 ] [ 2.601995e-10 2.989286e-10 1.853157e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 348.5871996 -279.2378017 -71.3278397 ] [ -512.4049458 -812.9305088 -909.7176875 ] [ 669.6910916 1197.9126501 651.5681958 ] [ 51.0204583 -440.2318003 217.9811142 ] [ -237.6134638 356.9484688 -100.7642369 ] [ -319.2803399 -22.461008 212.2604541 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.584982661106141e-07 -4.473882812132654e-07 -1.142797981210376e-07 ] [ -8.209632313067963e-07 -1.302458266265091e-06 -1.457528422449014e-06 ] [ 1.072963418959474e-06 1.919267657563238e-06 1.043927338768297e-06 ] [ 8.174378614423137e-08 -7.05329103984414e-07 3.492442478245256e-07 ] [ -3.806987396241648e-07 5.71894496253438e-07 -1.614421059040206e-07 ] [ -5.115435002833579e-07 -3.598650219368706e-08 3.400787398812495e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 554.18255 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.878983325805366e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.9592972 0.1626096 2.7022631 ] [ -0.2549 1.2244547 1.2945125 ] [ 0.186324 3.5029484 3.0491646 ] [ 3.0316073 -0.1888772 0.0205427 ] [ 1.8071617 2.4397333 -0.2164282 ] [ 2.9243039 2.8013447 2.3590671 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9592972e-10 1.626096e-11 2.7022631e-10 ] [ -2.549e-11 1.2244547e-10 1.2945125e-10 ] [ 1.86324e-11 3.5029484e-10 3.0491646e-10 ] [ 3.0316073e-10 -1.888772e-11 2.05427e-12 ] [ 1.8071617e-10 2.4397333e-10 -2.164282e-11 ] [ 2.9243039e-10 2.8013447e-10 2.3590671e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-06 4e-07 1.5e-06 ] [ -9e-07 -3.1e-06 1e-07 ] [ -6e-07 1.4e-06 1.2e-06 ] [ 1.3e-06 -1.6e-06 -1.3e-06 ] [ 6e-07 2.9e-06 -3e-07 ] [ 1.6e-06 0.0 -1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.204353268e-15 6.408706536e-16 2.403264951e-15 ] [ -1.4419589706e-15 -4.9667475654e-15 1.602176634e-16 ] [ -9.613059803999998e-16 2.2430472876e-15 1.9226119608e-15 ] [ 2.0828296242e-15 -2.5634826144e-15 -2.0828296242e-15 ] [ 9.613059803999998e-16 4.6463122386e-15 -4.806529901999999e-16 ] [ 2.5634826144e-15 0.0 -1.9226119608e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.345777 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.458664533997462e-18 } }