{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.619068 2.165174 1.589354 ] [ 4.694039 1.985014 2.658467 ] [ 3.289805 2.94692 4.226906 ] [ 3.352089 4.483007 2.429606 ] [ 5.033516 4.030044 3.913159 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.619068e-10 2.165174e-10 1.589354e-10 ] [ 4.694039000000001e-10 1.985014e-10 2.658467e-10 ] [ 3.289805e-10 2.94692e-10 4.226906e-10 ] [ 3.352089e-10 4.483007e-10 2.429606e-10 ] [ 5.033516e-10 4.030044e-10 3.913159e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5934526 -0.8276073 -3.9548013 ] [ 4.8672897 -9.8751823 -2.426637 ] [ -12.6360302 -9.577691 10.82432 ] [ -5.6250903 9.533693 -7.6139897 ] [ 15.9872834 10.7467876 3.171108 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.155169157106548e-09 -1.325973078187828e-09 -6.336290234972824e-09 ] [ 7.798257828248869e-09 -1.582178633755038e-08 -3.887901100599858e-09 ] [ -2.024515233295835e-08 -1.534515272787209e-08 1.734247258293888e-08 ] [ -9.012388242800048e-09 1.527466016032936e-08 -1.219895638885667e-08 ] [ 2.561445190461608e-08 1.721825198328094e-08 5.080675141490471e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.3523633 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.973254781939132e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.7136173 2.4882473 1.4657343 ] [ 4.4274505 2.076514 3.2146983 ] [ 3.2215378 1.6415604 5.2408395 ] [ 3.4350836 4.9688654 1.5382248 ] [ 5.1908278 4.4349719 3.3579951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7136173e-10 2.4882473e-10 1.4657343e-10 ] [ 4.4274505e-10 2.076514e-10 3.2146983e-10 ] [ 3.2215378e-10 1.6415604e-10 5.2408395e-10 ] [ 3.4350836e-10 4.9688654e-10 1.5382248e-10 ] [ 5.1908278e-10 4.4349719e-10 3.3579951e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.71e-05 -9e-06 8.5e-06 ] [ -3.71e-05 -1.85e-05 -2.26e-05 ] [ 8.8e-06 4e-06 3e-06 ] [ 5.1e-06 -2.2e-06 5.6e-06 ] [ 6.1e-06 2.56e-05 5.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.73972204414e-14 -1.4419589706e-14 1.3618501389e-14 ] [ -5.94407531214e-14 -2.9640267729e-14 -3.62091919284e-14 ] [ 1.40991543792e-14 6.408706535999999e-15 4.806529901999999e-15 ] [ 8.1711008334e-15 -3.5247885948e-15 8.972189150399999e-15 ] [ 9.773277467399999e-15 4.10157218304e-14 8.6517538236e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196954159838e-18 } }