{ "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" [ [ 2.61879 2.030613 1.31449 ] [ 0.5326459 2.599792 1.87087 ] [ 1.791863 1.569063 3.307142 ] [ 2.645053 4.244738 2.416375 ] [ 4.072939 1.030921 3.139936 ] [ 4.500349 3.153395 1.645552 ] [ 3.28786 3.426147 4.164789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61879e-10 2.030613e-10 1.31449e-10 ] [ 5.326459000000001e-11 2.599792e-10 1.87087e-10 ] [ 1.791863e-10 1.569063e-10 3.307142e-10 ] [ 2.645053e-10 4.244738e-10 2.416375e-10 ] [ 4.072939e-10 1.030921e-10 3.139936e-10 ] [ 4.500349e-10 3.153395e-10 1.645552e-10 ] [ 3.28786e-10 3.426147e-10 4.164789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5972576 -2.6492999 -4.9161019 ] [ -0.8138755 2.3775626 -0.424761 ] [ -0.6993474 -1.2927185 4.4466962 ] [ -3.2073352 1.8145242 -3.060783 ] [ 0.0474607 2.0391055 -0.5810382 ] [ 1.9653264 0.2246091 1.6938463 ] [ 2.1105134 -2.5137829 2.8421416 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.569121633151183e-10 -4.244646361267778e-09 -7.87646352965046e-09 ] [ -1.30397229834191e-09 3.809275212208462e-09 -6.805421436276287e-10 ] [ -1.120478054097266e-09 -2.071163357975645e-09 7.1243926914402e-09 ] [ -5.138717472508893e-09 2.907188251115823e-09 -4.903914963942087e-09 ] [ 7.604042394680257e-11 3.267007159444694e-09 -9.309258198317144e-10 ] [ 3.148800010321029e-09 3.598634488389293e-10 2.713840941088583e-09 ] [ 3.381415227365118e-09 -4.027524192146824e-09 4.553612824523106e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.865084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.624696274222815e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7132935 1.818585 1.0411908 ] [ 0.649923 2.6701144 1.7327877 ] [ 1.7224483 1.7942642 3.615203 ] [ 2.2990723 4.1931777 2.3819972 ] [ 3.9734335 1.1104017 2.9974158 ] [ 4.4864898 3.2448817 1.900123 ] [ 3.6048395 3.2232443 4.1904365 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7132935e-10 1.818585e-10 1.0411908e-10 ] [ 6.499230000000001e-11 2.6701144e-10 1.7327877e-10 ] [ 1.7224483e-10 1.7942642e-10 3.615203000000001e-10 ] [ 2.2990723e-10 4.1931777e-10 2.3819972e-10 ] [ 3.9734335e-10 1.1104017e-10 2.9974158e-10 ] [ 4.486489800000001e-10 3.2448817e-10 1.900123e-10 ] [ 3.6048395e-10 3.2232443e-10 4.1904365e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.83e-05 5.36e-05 7.27e-05 ] [ -7.86e-05 -1.05e-05 -2.52e-05 ] [ 6.95e-05 8.06e-05 -9.11e-05 ] [ 5.21e-05 -0.0001621 1.01e-05 ] [ -2.96e-05 0.000107 -4.58e-05 ] [ -9.21e-05 -7.6e-05 7.39e-05 ] [ 5.04e-05 7.4e-06 5.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.534159836864e-14 8.587666687488e-14 1.1647824033216e-13 ] [ -1.2593108239488e-13 -1.68228545184e-14 -4.037485084416e-14 ] [ 1.113512751456e-13 1.2913543563648e-13 -1.4595829015488e-13 ] [ 8.347340194367999e-14 -2.5971283023168e-13 1.618198387008e-14 ] [ -4.742442797568e-14 1.714328984256e-13 -7.337968923264e-14 ] [ -1.4756046677568e-13 -1.217654231808e-13 1.1840085227712e-13 ] [ 8.074970168832e-14 1.185610699392e-14 8.491536090240001e-15 ] ] } "relaxed-potential-energy" { "source-value" -32.25324 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.16753870730514e-18 } }