{ "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" [ [ 2.428537 1.662164 2.065612 ] [ 2.677805 2.654077 4.303636 ] [ 2.380622 3.799595 2.643621 ] [ 4.65403 2.78928 1.862185 ] [ 4.978196 2.955414 4.623231 ] [ 4.975087 5.409268 1.773954 ] [ 3.793479 4.953224 3.972917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.428537e-10 1.662164e-10 2.065612e-10 ] [ 2.677805e-10 2.654077e-10 4.303636e-10 ] [ 2.380622e-10 3.799595e-10 2.643621e-10 ] [ 4.65403e-10 2.78928e-10 1.862185e-10 ] [ 4.978196e-10 2.955414e-10 4.623231e-10 ] [ 4.975087000000001e-10 5.409268e-10 1.773954e-10 ] [ 3.793479e-10 4.953223999999999e-10 3.972917e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7696796 -5.4202766 -3.448527 ] [ -1.3047755 -3.1382702 6.411551 ] [ -2.9170352 5.4442584 -4.2853147 ] [ 1.7852524 3.6742167 2.8513561 ] [ 1.7950425 -1.145788 -2.5495652 ] [ -1.2830216 -3.5108539 1.7712916 ] [ 2.6942169 4.0967136 -0.7507918 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.233162670786466e-09 -8.684240518336964e-09 -5.525149381118117e-09 ] [ -2.090480818715667e-09 -5.028063185618506e-09 1.027243719989933e-08 ] [ -4.673605637995517e-09 8.722663597938224e-09 -6.865831081676719e-09 ] [ 2.860289681072421e-09 5.886744144992587e-09 4.568376118633366e-09 ] [ 2.875975150536945e-09 -1.835754761117592e-09 -4.084853790299537e-09 ] [ -2.055627228437294e-09 -5.625008083967771e-09 2.837922013520475e-09 ] [ 4.316611364107914e-09 6.563658806110022e-09 -1.202901078958801e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.8975 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.1879309575015e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.443238 1.4628988 2.1618001 ] [ 2.7202075 2.6726954 4.3419209 ] [ 2.2527387 4.0382233 2.2686259 ] [ 4.5133694 2.9328255 2.056016 ] [ 5.2168609 2.8864146 4.4387503 ] [ 4.9728871 5.2796512 1.9693817 ] [ 3.7684544 4.9503133 4.008661 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.443238e-10 1.4628988e-10 2.1618001e-10 ] [ 2.7202075e-10 2.6726954e-10 4.3419209e-10 ] [ 2.2527387e-10 4.0382233e-10 2.2686259e-10 ] [ 4.5133694e-10 2.9328255e-10 2.056016e-10 ] [ 5.2168609e-10 2.8864146e-10 4.4387503e-10 ] [ 4.972887100000001e-10 5.279651200000001e-10 1.9693817e-10 ] [ 3.7684544e-10 4.9503133e-10 4.008661e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.18e-05 1.08e-05 3.8e-05 ] [ -0.0001985 1.86e-05 -2.94e-05 ] [ -6.11e-05 -4.82e-05 -0.0001165 ] [ 0.0001539 2.21e-05 -2.34e-05 ] [ 0.0001988 -0.0001667 0.0001091 ] [ -0.0001294 6.3e-05 -0.0001093 ] [ 7.81e-05 0.0001004 0.0001315 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.697098330119999e-14 1.73035076472e-14 6.088271209199999e-14 ] [ -3.18032061849e-13 2.98004853924e-14 -4.710399303959999e-14 ] [ -9.789299233739998e-14 -7.72249137588e-14 -1.86653577861e-13 ] [ 2.465749839726e-13 3.54081036114e-14 -3.749093323559999e-14 ] [ 3.185127148392e-13 -2.670828448878e-13 1.747974707694e-13 ] [ -2.073216564396e-13 1.00937127942e-13 -1.751179060962e-13 ] [ 1.251299951154e-13 1.608585340536e-13 2.10686227371e-13 ] ] } "relaxed-potential-energy" { "source-value" -23.890225 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.827636027600265e-18 } }