{ "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" [ [ 2.272226 1.517825 2.823083 ] [ 2.079314 3.025232 4.309487 ] [ 1.624731 3.89644 2.167347 ] [ 4.204366 1.580563 1.938725 ] [ 4.130904 2.338344 4.256427 ] [ 3.588528 3.628489 1.149971 ] [ 3.881136 4.134812 3.114475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.272226e-10 1.517825e-10 2.823083e-10 ] [ 2.079314e-10 3.025232e-10 4.309487e-10 ] [ 1.624731e-10 3.89644e-10 2.167347e-10 ] [ 4.204366000000001e-10 1.580563e-10 1.938725e-10 ] [ 4.130904e-10 2.338344e-10 4.256427000000001e-10 ] [ 3.588528e-10 3.628489e-10 1.149971e-10 ] [ 3.881136e-10 4.134812e-10 3.114475e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9878023 -3.5340166 -1.4392878 ] [ -3.953314 3.1470056 3.4974797 ] [ -1.2993554 0.1337875 0.52173 ] [ 2.9821894 -1.4853788 -0.8866933 ] [ 3.5871593 -3.8502447 2.1108741 ] [ 0.4388276 0.1376482 -6.9299494 ] [ 1.2322954 5.4511989 3.1258467 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.786986992632468e-09 -5.662118774039106e-09 -2.305993263762667e-09 ] [ -6.333907265481331e-09 5.042058797846677e-09 5.603580207062597e-09 ] [ -2.081796843990232e-09 2.1435120465528e-10 8.35903608369984e-10 ] [ 4.77799413547758e-09 -2.379839186391959e-09 -1.420639275080001e-09 ] [ 5.747262765545294e-09 -6.168772042699111e-09 3.381993132472242e-09 ] [ 7.03079321281774e-10 2.205367279352026e-10 -1.110300291200699e-08 ] [ 1.974354879799384e-09 8.733783432910677e-09 5.008158502944832e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.523117158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.849009185975244e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.0570562 1.2260596 3.2009851 ] [ 2.0191166 3.3187383 4.4295653 ] [ 1.8736402 3.3516587 1.9718581 ] [ 3.9060782 1.7318714 1.756718 ] [ 4.1621165 2.1201666 4.1401526 ] [ 3.9051757 3.9901356 0.947037 ] [ 3.8580217 4.3830747 3.3131989 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0570562e-10 1.2260596e-10 3.2009851e-10 ] [ 2.0191166e-10 3.3187383e-10 4.4295653e-10 ] [ 1.8736402e-10 3.3516587e-10 1.9718581e-10 ] [ 3.9060782e-10 1.7318714e-10 1.756718e-10 ] [ 4.1621165e-10 2.1201666e-10 4.140152600000001e-10 ] [ 3.9051757e-10 3.9901356e-10 9.470370000000001e-11 ] [ 3.8580217e-10 4.3830747e-10 3.3131989e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.11e-05 -3.7e-06 1.17e-05 ] [ 3.81e-05 -1.08e-05 -3.67e-05 ] [ 2.27e-05 6e-07 1.29e-05 ] [ 2e-07 1.7e-05 2.8e-06 ] [ -9.3e-06 -4e-07 1.91e-05 ] [ -8.6e-06 9e-06 -3.2e-06 ] [ -2.2e-05 -1.17e-05 -6.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.380592669888e-14 -5.928053496960001e-15 1.874546646336e-14 ] [ 6.104292925248e-14 -1.730350750464e-14 -5.879988198335999e-14 ] [ 3.636940929216e-14 9.6130597248e-16 2.066807840832e-14 ] [ 3.2043532416e-16 2.72370025536e-14 4.48609453824e-15 ] [ -1.490024257344e-14 -6.408706483200001e-16 3.060157345728e-14 ] [ -1.377871893888e-14 1.44195895872e-14 -5.126965186560001e-15 ] [ -3.52478856576e-14 -1.874546646336e-14 -1.057436569728e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.103202158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.298276105265201e-18 } }