{ "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" [ [ 1.097689 0.3905239 0.41263 ] [ 0.032965 0.0756626 2.808384 ] [ 2.827906 0.6568563 1.349893 ] [ 2.515385 2.187975 0.7174512 ] [ 1.727021 2.867394 2.060494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.097689e-10 3.905239e-11 4.1263e-11 ] [ 3.2965e-12 7.56626e-12 2.808384e-10 ] [ 2.827906e-10 6.568562999999999e-11 1.349893e-10 ] [ 2.515385e-10 2.187975e-10 7.174512e-11 ] [ 1.727021e-10 2.867394e-10 2.060494e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.3718084 -3.3229847 -2.618471 ] [ 0.4885978 0.161058 -1.9769781 ] [ 13.3191142 -26.2004706 15.6386713 ] [ 7.6867149 18.0235268 -33.2240661 ] [ -12.1226185 11.3388706 22.1808438 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.501529243680492e-08 -5.324008441479499e-09 -4.195253053006614e-09 ] [ 7.828199785838051e-10 2.58043364318772e-10 -3.167468117749715e-09 ] [ 2.13395735568176e-08 -4.197778179512396e-08 2.50559137436664e-08 ] [ 1.231547500499965e-08 2.887687350123279e-08 -5.32308223918915e-08 ] [ -1.942257610359612e-08 1.816687353126956e-08 3.553762965876377e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 2.8425495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.554266389888383e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0727355 0.1500161 0.5886366 ] [ -0.1452327 0.2248002 2.5036295 ] [ 3.3458423 0.2442429 1.2987579 ] [ 2.2783006 2.2333664 0.5346147 ] [ 1.6493202 3.3259862 2.4232135 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0727355e-10 1.500161e-11 5.886366e-11 ] [ -1.452327e-11 2.248002e-11 2.5036295e-10 ] [ 3.3458423e-10 2.442429e-11 1.2987579e-10 ] [ 2.2783006e-10 2.2333664e-10 5.346147e-11 ] [ 1.6493202e-10 3.3259862e-10 2.4232135e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.4e-06 1.12e-05 3.7e-06 ] [ -8.4e-06 4.7e-06 2.5e-06 ] [ 2.14e-05 -5.1e-06 -5.2e-06 ] [ -1.4e-06 -6.3e-06 -6e-07 ] [ -8.2e-06 -4.6e-06 -4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.4474005556e-15 1.79443783008e-14 5.9280535458e-15 ] [ -1.34582837256e-14 7.530230179799999e-15 4.005441585e-15 ] [ 3.42865799676e-14 -8.1711008334e-15 -8.331318496799998e-15 ] [ -2.2430472876e-15 -1.00937127942e-14 -9.613059803999998e-16 ] [ -1.31378483988e-14 -7.370012516399999e-15 -6.408706536e-16 ] ] } "relaxed-potential-energy" { "source-value" -11.996903 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.92211576669645e-18 } }