{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 3.089476 2.842372 2.086496 ] [ 5.601196 2.528242 2.896237 ] [ 3.884312 0.6907176 1.701618 ] [ 4.215674 4.038258 3.881982 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.089476e-10 2.842372e-10 2.086496e-10 ] [ 5.601196e-10 2.528242e-10 2.896237e-10 ] [ 3.884312e-10 6.907176000000001e-11 1.701618e-10 ] [ 4.215674e-10 4.038258e-10 3.881982e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6802613 0.8049171 0.7151099 ] [ -3.0253671 -3.7093764 -2.6846375 ] [ 3.1760439 2.5083709 1.9287401 ] [ -0.830938 0.3960883 0.0407875 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.089898750895015e-09 1.289619359302136e-09 1.145732363082626e-09 ] [ -4.847172436957496e-09 -5.94307614582727e-09 -4.30126343782296e-09 ] [ 5.088583283214453e-09 4.018853212275055e-09 3.090182295819454e-09 ] [ -1.33130943693431e-09 6.346034140324167e-10 6.534877892087999e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4871092 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.520002455921659e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0971575 2.8966915 2.1403773 ] [ 5.4419419 2.3635031 2.8036916 ] [ 4.0490493 0.7629753 1.7506557 ] [ 4.2025093 4.0764197 3.8716083 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0971575e-10 2.8966915e-10 2.1403773e-10 ] [ 5.4419419e-10 2.3635031e-10 2.8036916e-10 ] [ 4.0490493e-10 7.629753e-11 1.7506557e-10 ] [ 4.2025093e-10 4.0764197e-10 3.8716083e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.6e-05 -6.5e-06 -2.8e-06 ] [ -1.87e-05 7.2e-06 -1.42e-05 ] [ -5e-06 -1.13e-05 0.0 ] [ -2.3e-06 1.06e-05 1.69e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.16565921408e-14 -1.04141480352e-14 -4.48609453824e-15 ] [ -2.996070280896e-14 1.153567166976e-14 -2.275090801536e-14 ] [ -8.010883104e-15 -1.810459581504e-14 0.0 ] [ -3.68500622784e-15 1.698307218048e-14 2.707678489152e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.280975 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.647193778402928e-18 } }