{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.239329 2.983674 3.512225 ] [ 2.999663 5.449943 1.062375 ] [ 1.178907 3.936124 1.554887 ] [ 2.122325 5.087093 3.38156 ] [ 3.136296 3.082629 1.288456 ] [ 5.117946 4.70791 1.219676 ] [ 3.839933 3.58316 3.463374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.239329e-10 2.983674e-10 3.512225e-10 ] [ 2.999663e-10 5.449943e-10 1.062375e-10 ] [ 1.178907e-10 3.936124e-10 1.554887e-10 ] [ 2.122325e-10 5.087093000000001e-10 3.38156e-10 ] [ 3.136296e-10 3.082629e-10 1.288456e-10 ] [ 5.117946e-10 4.70791e-10 1.219676e-10 ] [ 3.839933e-10 3.58316e-10 3.463374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2496004 -4.6597898 4.5094137 ] [ -1.3400344 4.3847582 -1.0102078 ] [ -7.2242564 1.4487854 -5.0417683 ] [ 0.3721831 5.5952677 2.1926839 ] [ 6.1832295 -3.7029476 -2.1001106 ] [ 1.5458961 -1.6220108 -0.2359399 ] [ 2.7125825 -1.4440632 1.6859291 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.604257196717053e-09 -7.465806336911534e-09 7.224877263179484e-09 ] [ -2.146971804436209e-09 7.025157133779898e-09 -1.618531332644545e-09 ] [ -1.157453480210496e-08 2.321210115560343e-09 -8.0778033643019e-09 ] [ 5.963030663896854e-10 8.964607169914922e-09 3.513066910327992e-09 ] [ 9.906625827559501e-09 -5.932776121646378e-09 -3.36474813213572e-09 ] [ 2.476798610011728e-09 -2.598747803855647e-09 -3.780173948082966e-10 ] [ 4.346036299297304e-09 -2.313644317059269e-09 2.701156210600649e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.997837 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.922265409994066e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4266614 3.7344757 3.3346562 ] [ 2.6644603 5.6873236 1.4861352 ] [ 1.5207913 3.510874 1.2175894 ] [ 2.4315235 4.9594851 3.8061288 ] [ 3.8542554 2.8218951 1.4334802 ] [ 4.6587788 4.8564575 0.4558812 ] [ 4.0779283 3.260022 3.7486821 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.266614e-11 3.7344757e-10 3.3346562e-10 ] [ 2.6644603e-10 5.6873236e-10 1.4861352e-10 ] [ 1.5207913e-10 3.510874e-10 1.2175894e-10 ] [ 2.4315235e-10 4.9594851e-10 3.806128800000001e-10 ] [ 3.8542554e-10 2.8218951e-10 1.4334802e-10 ] [ 4.6587788e-10 4.856457500000001e-10 4.558812e-11 ] [ 4.0779283e-10 3.260022e-10 3.7486821e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.2e-05 -7e-07 -3.92e-05 ] [ -2.75e-05 4e-07 2.6e-05 ] [ -5.27e-05 -2.63e-05 -2.95e-05 ] [ -3.8e-06 7.73e-05 3.91e-05 ] [ -1.38e-05 -4.77e-05 -2.18e-05 ] [ 3.54e-05 2.28e-05 -4.6e-06 ] [ 8.43e-05 -2.59e-05 3.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.5247885948e-14 -1.1215236438e-15 -6.280532405279998e-14 ] [ -4.4059857435e-14 6.408706536e-16 4.165659248399999e-14 ] [ -8.44347086118e-14 -4.21372454742e-14 -4.726421070299999e-14 ] [ -6.088271209199999e-15 1.238482538082e-13 6.26451063894e-14 ] [ -2.21100375492e-14 -7.64238254418e-14 -3.492745062119999e-14 ] [ 5.671705284359999e-14 3.65296272552e-14 -7.370012516399999e-15 ] [ 1.350634902462e-13 -4.149637482059999e-14 4.82255166834e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.197073 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.915492516779228e-18 } }