{ "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" [ [ 2.786609 1.867113 1.082186 ] [ 2.283835 1.161691 2.913478 ] [ 2.881264 2.452205 4.60424 ] [ 1.739559 3.43443 2.357326 ] [ 4.554937 2.252479 3.113794 ] [ 4.190396 3.99304 2.000834 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.786609e-10 1.867113e-10 1.082186e-10 ] [ 2.283835e-10 1.161691e-10 2.913478e-10 ] [ 2.881264e-10 2.452205e-10 4.60424e-10 ] [ 1.739559e-10 3.43443e-10 2.357326e-10 ] [ 4.554937e-10 2.252479e-10 3.113794e-10 ] [ 4.190396e-10 3.99304e-10 2.000834e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.6927898 0.9715946 -18.8230896 ] [ -6.3768745 -16.503331 11.1108434 ] [ 0.0327133 2.9399282 8.2418129 ] [ -5.0421188 9.8513982 -1.4461943 ] [ 9.1303522 -7.9635763 5.9279816 ] [ -0.4368619 10.7039863 -5.0113541 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.314324862288708e-09 1.556666153015528e-09 -3.015791408834362e-08 ] [ -1.021687923767569e-08 -2.644125109352388e-08 1.780153353284998e-08 ] [ 5.241248444921664e-11 4.710284228870627e-09 1.320483994138785e-08 ] [ -8.07836486065615e-09 1.57836798782312e-08 -2.317058696594221e-09 ] [ 1.462843683450985e-08 -1.275905576581697e-08 9.497673528052577e-09 ] [ -6.999299226982675e-10 1.71496765992235e-08 -8.029074377570226e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.4890917 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.192317770367328e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6345304 1.7493586 0.8566357 ] [ 2.2216917 0.2448722 2.9252951 ] [ 2.7082574 2.3395165 4.1843291 ] [ 2.1657117 3.7298953 2.2725357 ] [ 5.1467344 2.7964488 3.9508981 ] [ 4.5596744 4.3008666 1.8821643 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6345304e-10 1.7493586e-10 8.566357e-11 ] [ 2.2216917e-10 2.448722e-11 2.9252951e-10 ] [ 2.7082574e-10 2.3395165e-10 4.184329100000001e-10 ] [ 2.1657117e-10 3.7298953e-10 2.2725357e-10 ] [ 5.1467344e-10 2.7964488e-10 3.9508981e-10 ] [ 4.5596744e-10 4.3008666e-10 1.8821643e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.22e-05 -1.6e-06 2.2e-06 ] [ -2.48e-05 -5e-06 1.01e-05 ] [ 5.9e-06 3e-07 -1.86e-05 ] [ 1.14e-05 -1.34e-05 7.4e-06 ] [ 3.8e-06 -4e-06 1.3e-06 ] [ -8.5e-06 2.37e-05 -2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.954655477376e-14 -2.56348259328e-15 3.52478856576e-15 ] [ -3.973398019584e-14 -8.010883104e-15 1.618198387008e-14 ] [ 9.45284206272e-15 4.8065298624e-16 -2.980048514688e-14 ] [ 1.826481347712e-14 -2.146916671872e-14 1.185610699392e-14 ] [ 6.08827115904e-15 -6.4087064832e-15 2.08282960704e-15 ] [ -1.36185012768e-14 3.797158591296e-14 -3.84522388992e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.238735 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.761949818916669e-18 } }