{ "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" [ [ 2.70835 3.598 3.116557 ] [ 5.398567 2.472121 1.998263 ] [ 3.170959 1.761622 1.993892 ] [ 5.798068 2.225895 4.322659 ] [ 3.522139 1.857386 4.354431 ] [ 3.141461 3.938126 0.8725825 ] [ 4.820562 4.158888 3.263025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70835e-10 3.598e-10 3.116557e-10 ] [ 5.398567e-10 2.472121e-10 1.998263e-10 ] [ 3.170959e-10 1.761622e-10 1.993892e-10 ] [ 5.798068e-10 2.225895e-10 4.322659e-10 ] [ 3.522139e-10 1.857386e-10 4.354431e-10 ] [ 3.141461e-10 3.938126e-10 8.725825e-11 ] [ 4.820562e-10 4.158888e-10 3.263025e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.9318697 3.058245 2.2354632 ] [ 6.2243706 -2.037617 -4.5180698 ] [ -2.2514224 -4.8103708 -2.7720232 ] [ 1.4083688 -0.5764213 1.3018524 ] [ -3.0765514 -4.0332465 5.0957452 ] [ -1.4118292 1.5703462 -3.169088 ] [ 4.0389332 6.8290644 1.8261203 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.90172633017191e-09 4.899848639678496e-09 3.581606875698754e-09 ] [ 9.972541054514869e-09 -3.264622319544634e-09 -7.238745804702532e-09 ] [ -3.607176332825426e-09 -7.707063633138992e-09 -4.441270763355203e-09 ] [ 2.256455564824151e-09 -9.23528730591143e-10 2.08579747901237e-09 ] [ -4.92917872576951e-09 -6.461973248223427e-09 8.16428382499382e-09 ] [ -2.261999736802767e-09 2.515971968202121e-09 -5.07743870285783e-09 ] [ 6.471084346012931e-09 1.094136732361758e-08 2.925767251428282e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.09242 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.257854585449434e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7532085 4.2224483 3.4094032 ] [ 5.9666362 1.4452314 1.8101922 ] [ 3.5178215 1.4477738 1.5691732 ] [ 5.6627633 2.5315721 3.9970426 ] [ 3.3047172 1.9100296 3.9544239 ] [ 2.3410959 3.5522427 1.077931 ] [ 5.0138633 4.9027401 4.1032434 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7532085e-10 4.2224483e-10 3.4094032e-10 ] [ 5.9666362e-10 1.4452314e-10 1.8101922e-10 ] [ 3.5178215e-10 1.4477738e-10 1.5691732e-10 ] [ 5.6627633e-10 2.5315721e-10 3.9970426e-10 ] [ 3.3047172e-10 1.9100296e-10 3.9544239e-10 ] [ 2.3410959e-10 3.5522427e-10 1.077931e-10 ] [ 5.0138633e-10 4.9027401e-10 4.1032434e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.7e-06 1.19e-05 -1.58e-05 ] [ 2.3e-06 1.25e-05 -7.5e-06 ] [ -2.8e-06 -1.9e-06 7e-07 ] [ 4.7e-06 -9.7e-06 9e-07 ] [ -9.4e-06 -3.4e-06 6.2e-06 ] [ -2.7e-06 -1.39e-05 1.5e-06 ] [ 1.15e-05 4.6e-06 1.4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.928053496960001e-15 1.906590178752e-14 -2.531439060864e-14 ] [ 3.68500622784e-15 2.002720776e-14 -1.2016324656e-14 ] [ -4.48609453824e-15 -3.04413557952e-15 1.12152363456e-15 ] [ 7.53023011776e-15 -1.554111322176e-14 1.44195895872e-15 ] [ -1.506046023552e-14 -5.44740051072e-15 9.93349504896e-15 ] [ -4.32587687616e-15 -2.227025502912e-14 2.4032649312e-15 ] [ 1.84250311392e-14 7.370012455680001e-15 2.24304726912e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.155085 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.389418259803677e-18 } }