{ "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" [ [ 1.617948 3.024291 1.012928 ] [ 1.30973 1.622672 3.703727 ] [ 2.879916 3.04735 3.836046 ] [ 0.9226834 3.798669 3.025472 ] [ 3.183378 1.61886 2.358361 ] [ 3.567629 4.016165 2.010815 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.617948e-10 3.024291e-10 1.012928e-10 ] [ 1.30973e-10 1.622672e-10 3.703727e-10 ] [ 2.879916000000001e-10 3.04735e-10 3.836046e-10 ] [ 9.226834e-11 3.798669e-10 3.025472e-10 ] [ 3.183378e-10 1.61886e-10 2.358361e-10 ] [ 3.567629e-10 4.016165e-10 2.010815e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2916593 -1.7476831 1.99209 ] [ -3.1426758 -1.6169393 -2.3646564 ] [ 2.5158274 4.7485929 6.2054499 ] [ -0.8749961 0.6118243 0.5868064 ] [ 0.4544484 -1.8995281 -4.2089874 ] [ -0.2442631 -0.0962667 -2.2107025 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.069466349548796e-09 -2.800097026456685e-09 3.191680050825059e-09 ] [ -5.035121734997257e-09 -2.590622365056316e-09 -3.788597231518557e-09 ] [ 4.030799875456971e-09 7.608084588758298e-09 9.942226833237634e-09 ] [ -1.401898306261127e-09 9.80250597573406e-10 9.401675027616576e-10 ] [ 7.281066078386854e-10 -3.043379537446415e-09 -6.743541265080411e-09 ] [ -3.913526313684054e-10 -1.542362573722878e-10 -3.541935890225384e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.17617 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.873449467361178e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6569479 2.956409 1.0521741 ] [ 1.2821867 1.6061996 3.582498 ] [ 2.920372 3.1859809 4.050061 ] [ 0.8957863 3.8198356 3.0818095 ] [ 3.1742841 1.643404 2.2404322 ] [ 3.5517074 3.916178 1.9403742 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6569479e-10 2.956409e-10 1.0521741e-10 ] [ 1.2821867e-10 1.6061996e-10 3.582498e-10 ] [ 2.920372e-10 3.1859809e-10 4.050061e-10 ] [ 8.957863000000001e-11 3.8198356e-10 3.0818095e-10 ] [ 3.1742841e-10 1.643404e-10 2.2404322e-10 ] [ 3.5517074e-10 3.916178e-10 1.9403742e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.95e-05 3.02e-05 -5.43e-05 ] [ -2.87e-05 -3.54e-05 5.19e-05 ] [ 5.07e-05 -7.8e-06 8.5e-06 ] [ 1.64e-05 -2.57e-05 -3.01e-05 ] [ -3.56e-05 1.67e-05 2.4e-05 ] [ -2.22e-05 2.2e-05 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.1242444363e-14 4.838573434679999e-14 -8.69981912262e-14 ] [ -4.598246939579999e-14 -5.671705284359999e-14 8.315296730459999e-14 ] [ 8.123035534379999e-14 -1.24969777452e-14 1.3618501389e-14 ] [ 2.62756967976e-14 -4.11759394938e-14 -4.82255166834e-14 ] [ -5.703748817039999e-14 2.67563497878e-14 3.8452239216e-14 ] [ -3.55683212748e-14 3.5247885948e-14 0.0 ] ] } "relaxed-potential-energy" { "source-value" -26.007871 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.166920321628621e-18 } }