{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.992263 2.655886 1.517325 ] [ 2.686183 2.997874 4.828117 ] [ 1.135569 3.58045 3.551064 ] [ 3.228076 1.641916 3.257925 ] [ 4.134079 3.318369 1.708542 ] [ 3.231459 4.785804 3.060879 ] [ 4.593203 3.196107 3.900565 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992263e-10 2.655886e-10 1.517325e-10 ] [ 2.686183e-10 2.997874e-10 4.828117e-10 ] [ 1.135569e-10 3.58045e-10 3.551064e-10 ] [ 3.228076e-10 1.641916e-10 3.257925e-10 ] [ 4.134079e-10 3.318369e-10 1.708542e-10 ] [ 3.231459e-10 4.785804e-10 3.060879e-10 ] [ 4.593203e-10 3.196107e-10 3.900565e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.9301937 -0.9684696 -2.093295 ] [ -3.7698057 -1.5064183 13.8977147 ] [ -5.8113426 2.281614 -3.4785267 ] [ -1.510018 -10.307348 -3.8879756 ] [ 4.5617384 -0.8505459 -8.1133806 ] [ -2.7681828 9.4166922 -0.8774967 ] [ 13.2278045 1.9344756 4.5529599 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.296864513234005e-09 -1.551659363859326e-09 -3.35382833706903e-09 ] [ -6.039894607260013e-09 -2.413548201290002e-09 2.226659375833832e-08 ] [ -9.310797325888807e-09 3.655548638607275e-09 -5.573214199485128e-09 ] [ -2.419315556519412e-09 -1.651419212410663e-08 -6.22922365988213e-09 ] [ 7.308710674900546e-09 -1.362724767124501e-09 -1.29990688200689e-08 ] [ -4.435117800800694e-09 1.508720421241005e-08 -1.405904709152108e-09 ] [ 2.119327928902005e-08 3.09937160536313e-09 7.294645967318976e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.5482239 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.529794122878035e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0963435 2.3384657 1.6968683 ] [ 2.4434494 2.6811543 5.1382546 ] [ 1.3088443 3.9377192 3.3846472 ] [ 3.2457424 1.0518427 3.4187465 ] [ 4.1085716 3.6677015 1.3426778 ] [ 3.3062782 5.2970203 3.0621783 ] [ 4.4916026 3.2025023 3.7810443 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0963435e-10 2.3384657e-10 1.6968683e-10 ] [ 2.4434494e-10 2.6811543e-10 5.1382546e-10 ] [ 1.3088443e-10 3.9377192e-10 3.3846472e-10 ] [ 3.2457424e-10 1.0518427e-10 3.4187465e-10 ] [ 4.1085716e-10 3.6677015e-10 1.3426778e-10 ] [ 3.3062782e-10 5.2970203e-10 3.0621783e-10 ] [ 4.4916026e-10 3.2025023e-10 3.7810443e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.87e-05 3e-07 -2.27e-05 ] [ -3e-05 1e-06 8e-06 ] [ 2.26e-05 3.4e-06 4.1e-06 ] [ 4.17e-05 8e-06 3.81e-05 ] [ 3.82e-05 2.01e-05 -6.18e-05 ] [ 1.2e-05 -5.69e-05 3.85e-05 ] [ -2.59e-05 2.41e-05 -4.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.404776841579999e-14 4.806529901999999e-16 -3.636940959179999e-14 ] [ -4.806529901999999e-14 1.602176634e-15 1.2817413072e-14 ] [ 3.62091919284e-14 5.4474005556e-15 6.568924199399999e-15 ] [ 6.681076563779999e-14 1.2817413072e-14 6.10429297554e-14 ] [ 6.12031474188e-14 3.22037503434e-14 -9.901451598119999e-14 ] [ 1.9226119608e-14 -9.116385047459999e-14 6.168380040899999e-14 ] [ -4.149637482059999e-14 3.86124568794e-14 -6.568924199399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.65628 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.828847925936151e-18 } }