{ "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" [ [ 0.1446516 0.7602583 1.64121 ] [ 0.5863284 2.091282 0.4918312 ] [ 1.988461 0.5220119 2.855455 ] [ 2.293973 2.837851 0.0455476 ] [ 2.215952 2.17866 2.777134 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.446516e-11 7.602583e-11 1.64121e-10 ] [ 5.863284e-11 2.091282e-10 4.918312e-11 ] [ 1.988461e-10 5.220119e-11 2.855455e-10 ] [ 2.293973e-10 2.837851e-10 4.55476e-12 ] [ 2.215952e-10 2.17866e-10 2.777134e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.4946606 -12.0179405 5.2001756 ] [ -8.2978644 7.9868672 -10.4562408 ] [ 0.678046 -22.9112689 4.7130065 ] [ 8.6281576 3.1905132 -1.2749765 ] [ 7.4863214 23.7518289 1.8180351 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.36099466149509e-08 -1.925486329926546e-08 8.331599770374612e-09 ] [ -1.329464434424862e-08 1.279637190127436e-08 -1.675274455121509e-08 ] [ 1.086349449026957e-09 -3.670789938444213e-08 7.551068827978434e-09 ] [ 1.382383238729784e-08 5.111765657393795e-09 -2.042737540369411e-09 ] [ 1.199440912287472e-08 3.805462496482178e-08 2.91281333301379e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 1.3849452 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.21892682052918e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.0450615 0.3448684 1.6100421 ] [ 0.2600389 2.0199842 -0.0123461 ] [ 1.7102837 0.5120838 3.1663339 ] [ 2.2041267 3.2222674 0.5410812 ] [ 3.0999781 2.2908594 2.5060668 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.50615e-12 3.448684e-11 1.6100421e-10 ] [ 2.600389e-11 2.0199842e-10 -1.23461e-12 ] [ 1.7102837e-10 5.120838e-11 3.1663339e-10 ] [ 2.2041267e-10 3.2222674e-10 5.410812000000001e-11 ] [ 3.0999781e-10 2.2908594e-10 2.5060668e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4e-06 4.6e-06 -4.9e-06 ] [ 1.86e-05 -1.36e-05 5.5e-06 ] [ -3.1e-06 1.7e-05 1.18e-05 ] [ -1.59e-05 2.52e-05 5.1e-06 ] [ -3.6e-06 -3.33e-05 -1.75e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.4087064832e-15 7.370012455680001e-15 -7.850665441919999e-15 ] [ 2.980048514688e-14 -2.178960204288e-14 8.8119714144e-15 ] [ -4.96674752448e-15 2.72370025536e-14 1.890568412544e-14 ] [ -2.547460827072e-14 4.037485084416e-14 8.17110076608e-15 ] [ -5.76783583488e-15 -5.335248147264001e-14 -2.8038090864e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.837104 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.736295466597816e-18 } }