{ "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" [ [ 0.1837152 1.359189 0.2246076 ] [ 1.439885 0.3143995 0.1278355 ] [ 1.736921 1.45075 1.267781 ] [ 2.492617 0.9019618 2.872525 ] [ 2.597932 2.758406 2.155931 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.837152e-11 1.359189e-10 2.246076e-11 ] [ 1.439885e-10 3.143995e-11 1.278355e-11 ] [ 1.736921e-10 1.45075e-10 1.267781e-10 ] [ 2.492617e-10 9.019618e-11 2.872525e-10 ] [ 2.597932e-10 2.758406e-10 2.155931e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 862.2968125 2233.4285561 2414.3354654 ] [ 2012.6405664 -3794.9392284 -1950.5015342 ] [ -3094.5370712 1419.0281148 -741.7840142 ] [ 66.914768 -151.7449468 185.7747823 ] [ 152.6849243 294.2275043 92.1753007 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.381551804560179e-06 3.578347046291778e-06 3.868191869301395e-06 ] [ 3.224605688126605e-06 -6.080162959192469e-06 -3.125047982676391e-06 ] [ -4.957994988523433e-06 2.273533688521629e-06 -1.188469015025964e-06 ] [ 1.072092777591309e-07 -2.43122208090533e-07 2.976440153874967e-07 ] [ 2.446282180775188e-07 4.714044324695945e-07 1.476811130134638e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 586.15708 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.391271774296685e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.6064963 1.8725424 -0.9683233 ] [ 0.6051941 -1.1519811 -0.4553025 ] [ 1.6798379 1.3834368 1.3254942 ] [ 3.9698641 0.8150854 3.6030807 ] [ 2.8026705 3.8656229 3.1437311 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.064963e-11 1.8725424e-10 -9.683233e-11 ] [ 6.051941e-11 -1.1519811e-10 -4.553025e-11 ] [ 1.6798379e-10 1.3834368e-10 1.3254942e-10 ] [ 3.9698641e-10 8.150854e-11 3.6030807e-10 ] [ 2.8026705e-10 3.8656229e-10 3.1437311e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.3e-06 2.02e-05 -2.5e-06 ] [ -4.3e-06 3.3e-06 -3.7e-06 ] [ 3.89e-05 -4.35e-05 3.01e-05 ] [ -1.48e-05 1.01e-05 -1.3e-05 ] [ -1.26e-05 1e-05 -1.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.16958894282e-14 3.236396800679999e-14 -4.005441585e-15 ] [ -6.8893595262e-15 5.2871828922e-15 -5.9280535458e-15 ] [ 6.232467106259999e-14 -6.969468357899999e-14 4.82255166834e-14 ] [ -2.37122141832e-14 1.61819840034e-14 -2.082829624199999e-14 ] [ -2.01874255884e-14 1.602176634e-14 -1.73035076472e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.225055 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.638234420236487e-18 } }