{ "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" [ [ 0.8884438 2.916456 2.400624 ] [ 2.811423 1.824332 1.936915 ] [ 1.907829 2.277214 4.357236 ] [ 1.702277 4.831739 3.243262 ] [ 3.61245 3.93555 1.732923 ] [ 3.530316 5.918227 2.544774 ] [ 3.982422 3.894872 3.827608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.884438000000001e-11 2.916456e-10 2.400624e-10 ] [ 2.811423e-10 1.824332e-10 1.936915e-10 ] [ 1.907829e-10 2.277214e-10 4.357236e-10 ] [ 1.702277e-10 4.831739e-10 3.243262e-10 ] [ 3.61245e-10 3.93555e-10 1.732923e-10 ] [ 3.530316e-10 5.918227e-10 2.544774e-10 ] [ 3.982422e-10 3.894872e-10 3.827608e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9378981 -0.8511913 -1.4895446 ] [ 0.2543688 -1.6330377 0.2888749 ] [ 1.9085905 0.7170328 -0.0039789 ] [ -2.0054903 0.242762 1.8680895 ] [ 0.5425149 -3.2184208 -7.4423331 ] [ 1.792051 5.896824 0.6938616 ] [ 0.4458633 -1.153969 6.0850306 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.70703165011274e-09 -1.363758800688359e-09 -2.386513533758888e-09 ] [ 4.075437444209511e-10 -2.616414823825004e-09 4.628286111159379e-10 ] [ 3.057899077780983e-09 1.148813188506762e-09 -6.37490055650112e-12 ] [ -3.213149671901178e-09 3.889476008186496e-10 2.993009322461962e-09 ] [ 8.692046892156499e-10 -5.156478561656433e-09 -1.192393209702599e-08 ] [ 2.871182215481261e-09 9.447753549772338e-09 1.111688833590881e-09 ] [ 7.143517553327367e-10 -1.848862152927955e-09 9.749293764172597e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.966268 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.878513455262717e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6229657 3.1015774 2.3629364 ] [ 2.6455348 1.9468476 1.7564018 ] [ 2.2201383 2.3954791 4.1090103 ] [ 1.5294014 4.8006968 3.811695 ] [ 4.3002553 3.5963856 1.6935799 ] [ 3.1743493 5.6449571 2.2660915 ] [ 3.9425159 4.1124465 4.043627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.229656999999999e-11 3.1015774e-10 2.3629364e-10 ] [ 2.6455348e-10 1.9468476e-10 1.7564018e-10 ] [ 2.2201383e-10 2.3954791e-10 4.1090103e-10 ] [ 1.5294014e-10 4.8006968e-10 3.811695e-10 ] [ 4.3002553e-10 3.5963856e-10 1.6935799e-10 ] [ 3.1743493e-10 5.6449571e-10 2.2660915e-10 ] [ 3.9425159e-10 4.1124465e-10 4.043627e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.3e-06 -1.01e-05 2.85e-05 ] [ 2.1e-06 1.03e-05 -1.86e-05 ] [ -7e-07 -8.3e-06 8.3e-06 ] [ -2.81e-05 1.33e-05 -1.03e-05 ] [ 1.81e-05 -2.1e-06 2.4e-06 ] [ 1.86e-05 -1.7e-06 5.8e-06 ] [ -3.9e-06 -1.4e-06 -1.6e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.009371271104e-14 -1.618198387008e-14 4.56620336928e-14 ] [ 3.36457090368e-15 1.650241919424e-14 -2.980048514688e-14 ] [ -1.12152363456e-15 -1.329806595264e-14 1.329806595264e-14 ] [ -4.502116304448e-14 2.130894905664e-14 -1.650241919424e-14 ] [ 2.899939683648e-14 -3.36457090368e-15 3.84522388992e-15 ] [ 2.980048514688e-14 -2.72370025536e-15 9.292624400640001e-15 ] [ -6.24848882112e-15 -2.24304726912e-15 -2.56348259328e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.946238 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.516174943811256e-18 } }