{ "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" [ [ 0.4656555 2.854978 2.130075 ] [ 2.415045 0.7163998 1.216409 ] [ 1.531563 1.029003 2.475027 ] [ 2.019704 2.428405 0.6522284 ] [ 2.764103 2.749341 2.416687 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.656555e-11 2.854978e-10 2.130075e-10 ] [ 2.415045e-10 7.163998000000001e-11 1.216409e-10 ] [ 1.531563e-10 1.029003e-10 2.475027e-10 ] [ 2.019704e-10 2.428405e-10 6.522284e-11 ] [ 2.764103e-10 2.749341e-10 2.416687e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -22.3931684 14.6855472 5.24816 ] [ 26.3482465 -35.2929091 -30.0472337 ] [ -23.9350027 -16.5443811 38.8235534 ] [ -0.2941463 18.2915491 -31.3562304 ] [ 20.2740709 18.860194 17.3317507 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.587781087611734e-08 2.35288403874949e-08 8.408479254217729e-09 ] [ 4.221454454137543e-08 -5.654547384003957e-08 -4.814097535385388e-08 ] [ -3.834810174472488e-08 -2.650702060402539e-08 6.220218959386036e-08 ] [ -4.712743249548231e-10 2.930629232623528e-08 -5.023821926329823e-08 ] [ 3.248264240442162e-08 3.021736189055244e-08 2.776852576907404e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 24.198263 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.876989124256967e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0751941 2.6012798 1.7989548 ] [ 2.2553762 0.3904518 0.8261793 ] [ 1.5260166 1.0565719 3.119422 ] [ 2.1524159 2.8546708 0.4367421 ] [ 3.1870677 2.8751525 2.7091282 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.51941e-12 2.6012798e-10 1.7989548e-10 ] [ 2.2553762e-10 3.904518e-11 8.261793e-11 ] [ 1.5260166e-10 1.0565719e-10 3.119422e-10 ] [ 2.1524159e-10 2.8546708e-10 4.367421e-11 ] [ 3.1870677e-10 2.8751525e-10 2.7091282e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 6.5e-06 -2.83e-05 ] [ 3.9e-06 1.35e-05 1.48e-05 ] [ 2.18e-05 1.11e-05 -4.6e-06 ] [ -1.95e-05 -2.3e-06 3.43e-05 ] [ -5.8e-06 -2.88e-05 -1.63e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706483200001e-16 1.04141480352e-14 -4.534159836864e-14 ] [ 6.24848882112e-15 2.16293843808e-14 2.371221398784e-14 ] [ 3.492745033344e-14 1.778416049088e-14 -7.370012455680001e-15 ] [ -3.12424441056e-14 -3.68500622784e-15 5.495465809344e-14 ] [ -9.292624400640001e-15 -4.614268667904e-14 -2.611547891904e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.731874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.719435762017138e-18 } }