{ "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" [ [ 1.305811 2.49596 1.153083 ] [ 2.737889 0.6120376 2.536176 ] [ 2.287817 4.454983 1.771215 ] [ 3.462438 1.614504 0.7986264 ] [ 3.194185 2.806829 3.238803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.305811e-10 2.49596e-10 1.153083e-10 ] [ 2.737889e-10 6.120375999999999e-11 2.536176e-10 ] [ 2.287817e-10 4.454983e-10 1.771215e-10 ] [ 3.462438e-10 1.614504e-10 7.986264e-11 ] [ 3.194185e-10 2.806829e-10 3.238803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7505138 0.8540852 -1.9789334 ] [ -0.1022585 -3.689865 4.6989883 ] [ 0.2295582 1.0966985 0.8237607 ] [ 1.8868189 -0.6693808 -7.6955089 ] [ -0.2636048 2.4084621 4.1516933 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.804632307854549e-09 1.368395350885217e-09 -3.170600853722175e-09 ] [ -1.63836179327889e-10 -5.91181548561441e-09 7.528609257699382e-09 ] [ 3.677927841830987e-10 1.757104711242849e-09 1.319810145547484e-09 ] [ 3.023017154169582e-09 -1.072466277008227e-09 -1.232956454631904e-08 ] [ -4.223414511702431e-10 3.858781700494571e-09 6.651745996794351e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.2720305 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.485543061683534e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7266077 3.0334204 0.2437716 ] [ 3.500373 0.8522673 2.739141 ] [ 2.0079789 4.2595139 2.1969518 ] [ 2.6489541 0.9276249 0.5788642 ] [ 3.1042264 2.9114871 3.7391748 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7266077e-10 3.0334204e-10 2.437716e-11 ] [ 3.500373e-10 8.522673e-11 2.739141e-10 ] [ 2.0079789e-10 4.2595139e-10 2.1969518e-10 ] [ 2.6489541e-10 9.276249e-11 5.788642000000001e-11 ] [ 3.1042264e-10 2.9114871e-10 3.7391748e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.3e-06 7.8e-06 -5.7e-06 ] [ 1.8e-06 -1.02e-05 1e-07 ] [ -2.7e-06 8.5e-06 -1.3e-06 ] [ 5.6e-06 -1.03e-05 -2.5e-06 ] [ 2.7e-06 4.2e-06 9.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.16958894282e-14 1.24969777452e-14 -9.1324068138e-15 ] [ 2.8839179412e-15 -1.63422016668e-14 1.602176634e-16 ] [ -4.3258769118e-15 1.3618501389e-14 -2.0828296242e-15 ] [ 8.972189150399999e-15 -1.65024193302e-14 -4.005441585e-15 ] [ 4.3258769118e-15 6.729141862799999e-15 1.50604603596e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.43342 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992053500470828e-18 } }