{ "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" [ [ 0.2519361 0.630526 0.2961672 ] [ 1.040527 1.338339 0.9480581 ] [ 1.471162 2.964903 0.310665 ] [ 0.0960364 2.590998 1.829013 ] [ 2.039261 0.0625187 0.2196196 ] [ 2.19391 1.549757 2.906446 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.519361e-11 6.30526e-11 2.961672e-11 ] [ 1.040527e-10 1.338339e-10 9.480581e-11 ] [ 1.471162e-10 2.964903e-10 3.10665e-11 ] [ 9.60364e-12 2.590998e-10 1.829013e-10 ] [ 2.039261e-10 6.25187e-12 2.196196e-11 ] [ 2.19391e-10 1.549757e-10 2.906446e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -93.9853875 -75.935275 -66.4807388 ] [ 69.2761726 49.1265817 63.9236019 ] [ 12.4980683 35.1633319 -18.4802959 ] [ -20.972703 19.8468134 20.3026661 ] [ 26.7904759 -25.8712106 -10.9401827 ] [ 6.3933738 -2.3302413 11.6749495 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.505811905493285e-07 -1.216617222990187e-07 -1.065138854388714e-07 ] [ 1.109926641182256e-07 7.870946065956112e-08 1.024169004815065e-07 ] [ 2.00241128354216e-08 5.633786827961085e-08 -2.96086980364461e-08 ] [ -3.360197442158203e-08 3.179810042686016e-08 3.252845696532871e-08 ] [ 4.292307414708584e-08 -4.145024877511314e-08 -1.752810494922062e-08 ] [ 1.024331403039525e-08 -3.733458131682599e-09 1.870533113792065e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 52.712033 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.445398690743809e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6700586 -0.1948474 0.0641922 ] [ 1.9129724 1.5568627 1.0218946 ] [ 0.9118927 3.6474662 0.446283 ] [ 0.2338451 3.9489217 2.7163673 ] [ 2.1261207 -1.6813755 -1.0314696 ] [ 1.237943 1.8600138 3.2927014 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.700586e-11 -1.948474e-11 6.419220000000001e-12 ] [ 1.9129724e-10 1.5568627e-10 1.0218946e-10 ] [ 9.118927e-11 3.6474662e-10 4.46283e-11 ] [ 2.338451e-11 3.9489217e-10 2.7163673e-10 ] [ 2.1261207e-10 -1.6813755e-10 -1.0314696e-10 ] [ 1.237943e-10 1.8600138e-10 3.2927014e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.44e-05 2.57e-05 4.09e-05 ] [ -1.51e-05 -2.19e-05 -2.34e-05 ] [ -1.6e-06 3e-06 -2.57e-05 ] [ 2.3e-06 2.6e-05 2.05e-05 ] [ 9e-07 1.09e-05 6.8e-06 ] [ -1.1e-05 -4.37e-05 -1.91e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.909310954752e-14 4.117593915456e-14 6.552902379072e-14 ] [ -2.419286697408e-14 -3.508766799552e-14 -3.749093292672001e-14 ] [ -2.56348259328e-15 4.8065298624e-15 -4.117593915456e-14 ] [ 3.68500622784e-15 4.16565921408e-14 3.28446207264e-14 ] [ 1.44195895872e-15 1.746372516672e-14 1.089480102144e-14 ] [ -1.76239428288e-14 -7.001511832895999e-14 -3.060157345728e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.476877 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.999016062999724e-18 } }