{ "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" [ [ 1.047673 1.456203 2.59416 ] [ 0.648425 2.408552 0.8864435 ] [ 2.028254 0.9559849 0.3097335 ] [ 1.556479 0.0798405 1.221415 ] [ 2.621496 2.506538 1.825694 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.047673e-10 1.456203e-10 2.59416e-10 ] [ 6.48425e-11 2.408552e-10 8.864435000000001e-11 ] [ 2.028254e-10 9.559849e-11 3.097335e-11 ] [ 1.556479e-10 7.98405e-12 1.221415e-10 ] [ 2.621496e-10 2.506538e-10 1.825694e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.8823891 -2.4117601 34.5078481 ] [ -26.6902506 24.0000833 -14.6944749 ] [ -74.8558653 -176.0707142 142.4844371 ] [ 88.0374524 131.6597413 -172.5374597 ] [ 28.3910526 22.8226497 10.2396494 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.384421587766875e-08 -3.86406564719827e-09 5.528766745993769e-08 ] [ -4.276249551461317e-08 3.845237236051251e-08 -2.354314413971242e-08 ] [ -1.19932317313414e-07 -2.820963818987985e-07 2.282852339494682e-07 ] [ 1.410515479900728e-07 2.109421594114362e-07 -2.764354841435622e-07 ] [ 4.548748071562305e-08 3.656591577404814e-08 1.640572687386875e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 217.1483 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.479099295064647e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.0094606 1.4500033 2.6827707 ] [ 0.5799396 2.470183 0.848713 ] [ 1.8092867 0.4609051 0.7270086 ] [ 1.8092867 0.4609051 0.7270086 ] [ 2.6943533 2.565122 1.8519451 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0094606e-10 1.4500033e-10 2.6827707e-10 ] [ 5.799396e-11 2.470183e-10 8.487130000000001e-11 ] [ 1.8092867e-10 4.609051e-11 7.270086e-11 ] [ 1.8092867e-10 4.609051e-11 7.270086e-11 ] [ 2.6943533e-10 2.565122e-10 1.8519451e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -14.9855877 -3.3487813 35.115261 ] [ -24.1472766 24.5393979 -14.9981592 ] [ 1.4130755044388775e+113 -21.5563547 -13.9795155 ] [ -1.4130755044388775e+113 -21.5563547 -13.9795155 ] [ 26.2588546 21.9220928 7.8419291 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.400955826188804e-08 -5.365339107032231e-09 5.626085020749002e-08 ] [ -3.868820202451092e-08 3.931644960388862e-08 -2.402970002527643e-08 ] [ 2.263996536637136e+104 -3.45370875300122e-08 -2.239765290421122e-08 ] [ -2.263996536637136e+104 -3.45370875300122e-08 -2.239765290421122e-08 ] [ 4.207132292910653e-08 3.512306456316801e-08 1.256415546599119e-08 ] ] } "relaxed-potential-energy" { "source-value" -5.2294299e+96 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.378470325892482e+77 } }