{ "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" [ [ 1.558502 1.467528 2.474942 ] [ 1.379624 2.873279 4.407553 ] [ 1.24144 3.597751 1.918679 ] [ 3.591005 1.301821 3.64335 ] [ 3.465479 3.687448 2.931727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.558502e-10 1.467528e-10 2.474942e-10 ] [ 1.379624e-10 2.873279e-10 4.407553e-10 ] [ 1.24144e-10 3.597751e-10 1.918679e-10 ] [ 3.591005e-10 1.301821e-10 3.64335e-10 ] [ 3.465479e-10 3.687448e-10 2.931727e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6164905 -0.4883473 0.49929 ] [ 2.4606847 -0.3358386 -2.6044315 ] [ 0.7784194 0.6532098 1.3915617 ] [ -1.6396147 2.3158593 0.0727391 ] [ -2.2159799 -2.1448831 0.6408407 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.877266660453025e-10 -7.824186268908038e-10 7.999507649992321e-10 ] [ 3.942451497500262e-09 -5.380727532822029e-10 -4.172759259775075e-09 ] [ 1.247165363857164e-09 1.046557470037444e-09 2.229527622140704e-09 ] [ -2.626952339460006e-09 3.710415627522254e-09 1.165408854380333e-10 ] [ -3.550391187942722e-09 -3.436481557169029e-09 1.026739987197107e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.839933 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.178707681083841e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8175917 1.500549 2.2308558 ] [ 1.5582897 2.8521139 4.3118489 ] [ 1.0894254 3.7395408 2.1815035 ] [ 3.4049975 1.4315904 3.9689994 ] [ 3.3657457 3.4040329 2.6830434 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8175917e-10 1.500549e-10 2.2308558e-10 ] [ 1.5582897e-10 2.8521139e-10 4.3118489e-10 ] [ 1.0894254e-10 3.7395408e-10 2.1815035e-10 ] [ 3.4049975e-10 1.4315904e-10 3.9689994e-10 ] [ 3.3657457e-10 3.4040329e-10 2.6830434e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.55e-05 6.8e-06 1.47e-05 ] [ 3.68e-05 -2.04e-05 1.3e-06 ] [ -3.66e-05 3.67e-05 -4.09e-05 ] [ -2.4e-06 -9e-07 6.8e-06 ] [ -1.33e-05 -2.23e-05 1.82e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.48337376224e-14 1.089480102144e-14 2.355199632576e-14 ] [ 5.896009964544001e-14 -3.268440306432e-14 2.08282960704e-15 ] [ -5.863966432128e-14 5.879988198335999e-14 -6.552902379072e-14 ] [ -3.84522388992e-15 -1.44195895872e-15 1.089480102144e-14 ] [ -2.130894905664e-14 -3.572853864384e-14 2.915961449856e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.115797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.383123628295878e-18 } }