{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.248369 0.1750326 1.959235 ] [ 0.2041437 1.690187 0.8451771 ] [ 0.5672117 2.337944 2.235934 ] [ 2.305261 0.0188332 0.1900716 ] [ 2.629759 0.4646214 2.471997 ] [ 1.518408 2.931316 1.102854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.248369e-10 1.750326e-11 1.959235e-10 ] [ 2.041437e-11 1.690187e-10 8.451771e-11 ] [ 5.672117e-11 2.337944e-10 2.235934e-10 ] [ 2.305261e-10 1.88332e-12 1.900716e-11 ] [ 2.629759e-10 4.646214e-11 2.471997e-10 ] [ 1.518408e-10 2.931316e-10 1.102854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.3001187 -14.1222595 6.3280324 ] [ -4.7766032 -10.7920892 -15.7180056 ] [ 1.1797642 0.5183172 18.3931474 ] [ -2.1835524 2.210071 -10.6881314 ] [ 5.9476722 7.9362337 8.9831083 ] [ 11.1328379 14.2497267 -7.2981511 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.810478614256645e-08 -2.262635419018452e-08 1.013862565047494e-08 ] [ -7.652962036929628e-09 -1.729083314828375e-08 -2.518302130540115e-08 ] [ 1.890190634869702e-09 8.304357068403048e-10 2.946907098999785e-08 ] [ -3.498436634394621e-09 3.540924115681014e-09 -1.71242743902017e-08 ] [ 9.529221425531375e-09 1.271524819610336e-08 1.439252621895146e-08 ] [ 1.783677275348963e-08 2.283057915962593e-08 -1.16929271638214e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.3067013 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.900096192477424e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4778851 -0.1655565 2.106232 ] [ 0.431794 1.4916446 0.2359959 ] [ 1.0800748 2.178855 2.7285847 ] [ 2.3456804 -0.0925559 0.26516 ] [ 2.9529489 0.5511785 2.6000717 ] [ 1.1847692 3.6543684 0.8692243 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.778851e-11 -1.655565e-11 2.106232e-10 ] [ 4.31794e-11 1.4916446e-10 2.359959e-11 ] [ 1.0800748e-10 2.178855e-10 2.7285847e-10 ] [ 2.3456804e-10 -9.25559e-12 2.6516e-11 ] [ 2.9529489e-10 5.511785000000001e-11 2.6000717e-10 ] [ 1.1847692e-10 3.6543684e-10 8.692243e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.34e-05 2.15e-05 -2.49e-05 ] [ 1.42e-05 -3.1e-06 2.73e-05 ] [ -4.8e-06 -1.15e-05 -1.49e-05 ] [ -2.2e-05 6.1e-06 2.93e-05 ] [ -1.86e-05 -3.6e-06 -1.58e-05 ] [ -2.2e-06 -9.4e-06 -1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.351269957559999e-14 3.4446797631e-14 -3.989419818659999e-14 ] [ 2.27509082028e-14 -4.9667475654e-15 4.37394221082e-14 ] [ -7.690447843199998e-15 -1.8425031291e-14 -2.38724318466e-14 ] [ -3.5247885948e-14 9.773277467399999e-15 4.69437753762e-14 ] [ -2.98004853924e-14 -5.767835882399999e-15 -2.53143908172e-14 ] [ -3.5247885948e-15 -1.50604603596e-14 -1.602176634e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.703091 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.156783201777569e-18 } }