{ "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" [ [ 0.4009464 1.193297 0.9558509 ] [ 0.2244953 2.906435 0.4394059 ] [ 0.3187826 2.815079 2.795658 ] [ 1.502588 0.0124763 2.860219 ] [ 2.103704 2.743898 0.1444875 ] [ 2.704733 1.991532 2.940817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.009464e-11 1.193297e-10 9.558509e-11 ] [ 2.244953e-11 2.906435e-10 4.394059e-11 ] [ 3.187826e-11 2.815079e-10 2.795658e-10 ] [ 1.502588e-10 1.24763e-12 2.860219e-10 ] [ 2.103704e-10 2.743898e-10 1.444875e-11 ] [ 2.704733e-10 1.991532e-10 2.940817e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.8155899 -46.0054844 10.3435834 ] [ -23.7218174 40.1995455 -11.8949881 ] [ 1.0808804 2.0113717 6.2589116 ] [ -0.2570514 -1.9649389 -0.4617486 ] [ 25.7640649 2.8618279 -5.7172152 ] [ 0.9495133 2.8976781 1.471457 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.11324893234061e-09 -7.37089115342591e-08 1.657224749877497e-08 ] [ -3.800654124116664e-08 6.440677196688585e-08 -1.905787183851421e-08 ] [ 1.731761306760952e-09 3.222572713478752e-09 1.002788183717392e-08 ] [ -4.118417434239091e-10 -3.148179166880469e-09 -7.398028116071308e-10 ] [ 4.12785824395539e-08 4.585153754133161e-09 -9.159988529522397e-09 ] [ 1.521288010398657e-09 4.642592106424164e-09 2.357534003912506e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 4.1102681 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.585375455040037e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.3484875 0.8290627 1.5617124 ] [ 0.3186223 2.9376423 0.3093925 ] [ 0.0776618 2.9845767 2.8390529 ] [ 2.0380653 0.2157807 1.8004123 ] [ 2.7051753 2.3243654 0.5481034 ] [ 2.4642121 2.3712895 3.0777648 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.484875e-11 8.290627e-11 1.5617124e-10 ] [ 3.186223e-11 2.9376423e-10 3.093925000000001e-11 ] [ 7.766180000000001e-12 2.9845767e-10 2.8390529e-10 ] [ 2.0380653e-10 2.157807e-11 1.8004123e-10 ] [ 2.7051753e-10 2.3243654e-10 5.481034e-11 ] [ 2.4642121e-10 2.3712895e-10 3.0777648e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.3e-06 -9.2e-06 -1.06e-05 ] [ 9.4e-06 5.1e-06 2.5e-06 ] [ 3.9e-06 6e-07 1.34e-05 ] [ -8.9e-06 -5e-06 1.09e-05 ] [ -5.4e-06 1.4e-06 -3.1e-06 ] [ -6.3e-06 7.1e-06 -1.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.169588933184e-14 -1.474002491136e-14 -1.698307218048e-14 ] [ 1.506046023552e-14 8.17110076608e-15 4.005441552e-15 ] [ 6.24848882112e-15 9.6130597248e-16 2.146916671872e-14 ] [ -1.425937192512e-14 -8.010883104e-15 1.746372516672e-14 ] [ -8.65175375232e-15 2.24304726912e-15 -4.96674752448e-15 ] [ -1.009371271104e-14 1.137545400768e-14 -2.098851373248e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.599118 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.659471878550046e-18 } }