{ "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" [ [ 1.797173 1.880519 2.621604 ] [ 2.732492 2.231734 4.550403 ] [ 1.229923 3.945183 3.396256 ] [ 3.798537 2.960677 2.455754 ] [ 3.373455 4.934702 3.584472 ] [ 4.913806 3.358248 4.34106 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.797173e-10 1.880519e-10 2.621604e-10 ] [ 2.732492e-10 2.231734e-10 4.550403000000001e-10 ] [ 1.229923e-10 3.945183e-10 3.396256e-10 ] [ 3.798537e-10 2.960677e-10 2.455754e-10 ] [ 3.373455e-10 4.934702e-10 3.584472e-10 ] [ 4.913806e-10 3.358248e-10 4.34106e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6871811 -1.8072037 -2.646447 ] [ -0.3564522 -7.6186662 11.1118771 ] [ -4.6891561 4.540231 -0.7250482 ] [ 3.5409353 -2.2220041 -13.0724182 ] [ -1.9992892 8.0634818 -0.5413516 ] [ 5.1911433 -0.9558387 5.8733879 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.703162135746417e-09 -2.895459541018346e-09 -4.240075546519398e-09 ] [ -5.710993859778948e-10 -1.220644896788557e-08 1.780318984949968e-08 ] [ -7.512856336598566e-09 7.274252021162454e-09 -1.161655284563759e-09 ] [ 5.67320380016578e-09 -3.560043049672199e-09 -2.094432298991634e-08 ] [ -3.203214440848553e-09 1.291912212864426e-08 -8.673408842985144e-10 ] [ 8.317128499005652e-09 -1.531422431012936e-09 9.410204855798327e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.9719202 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.117024763855261e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9531379 1.9497547 2.6203062 ] [ 2.6836604 1.8729372 5.0204847 ] [ 1.1197096 4.1015087 3.6081057 ] [ 4.0958138 3.0066006 1.9152708 ] [ 3.3490742 5.1127332 3.3079904 ] [ 4.6439902 3.2675287 4.4773911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9531379e-10 1.9497547e-10 2.6203062e-10 ] [ 2.6836604e-10 1.8729372e-10 5.0204847e-10 ] [ 1.1197096e-10 4.1015087e-10 3.6081057e-10 ] [ 4.0958138e-10 3.0066006e-10 1.9152708e-10 ] [ 3.3490742e-10 5.1127332e-10 3.3079904e-10 ] [ 4.6439902e-10 3.267528700000001e-10 4.4773911e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.8e-06 -7.1e-06 -4.8e-06 ] [ 2.68e-05 -7e-06 -1.4e-06 ] [ 3.2e-06 1.87e-05 -6.2e-06 ] [ -1.73e-05 1.16e-05 1.88e-05 ] [ 3.6e-06 -8.7e-06 -1.35e-05 ] [ -2.01e-05 -7.7e-06 7.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.088271209199999e-15 -1.13754541014e-14 -7.690447843199998e-15 ] [ 4.293833379119999e-14 -1.1215236438e-14 -2.2430472876e-15 ] [ 5.1269652288e-15 2.99607030558e-14 -9.9334951308e-15 ] [ -2.77176557682e-14 1.85852489544e-14 3.012092071919999e-14 ] [ 5.767835882399999e-15 -1.39389367158e-14 -2.162938455899999e-14 ] [ -3.22037503434e-14 -1.23367600818e-14 1.15356717648e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.32232 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.294688644867088e-18 } }