{ "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" [ [ -37.0777112 -28.438285 -11.0661302 ] [ -25.2281553 -26.3551966 -41.5968714 ] [ -17.9519698 21.5539233 64.7229409 ] [ 1.0207864 -4.1447294 -20.0733362 ] [ 45.2162999 9.9865935 31.5690443 ] [ 34.0207501 27.3976941 -23.5556474 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.940504203741432e-08 -4.556315536264733e-08 -1.772989508916883e-08 ] [ -4.041996060757161e-08 -4.222567982910765e-08 -6.664553485550417e-08 ] [ -2.876222631086765e-08 3.453319199777638e-08 1.036975827394001e-07 ] [ 1.635480104910597e-09 -6.640588544222412e-09 -3.216102996109831e-08 ] [ 7.244449857886139e-08 1.600028662713324e-08 5.05791847184595e-08 ] [ 5.450725043229927e-08 4.38959449508501e-08 -3.774030755208831e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 31.108254 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.984091727270808e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5165604 -0.2102034 1.3739843 ] [ -0.2854832 1.0587393 1.5383847 ] [ 0.1093446 3.2194008 1.7020428 ] [ 2.3406564 -0.7502584 -0.5944009 ] [ 2.7468532 0.0380772 3.1892419 ] [ 2.0452211 4.2621788 1.5960159 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5165604e-10 -2.102034e-11 1.3739843e-10 ] [ -2.854832e-11 1.0587393e-10 1.5383847e-10 ] [ 1.093446e-11 3.2194008e-10 1.7020428e-10 ] [ 2.3406564e-10 -7.502584e-11 -5.944009e-11 ] [ 2.7468532e-10 3.80772e-12 3.1892419e-10 ] [ 2.0452211e-10 4.2621788e-10 1.5960159e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0587548 0.1867403 0.469408 ] [ 0.0236894 -0.0081486 -0.0450164 ] [ 0.0364077 0.0912886 -0.028753 ] [ 0.1255035 -0.2842377 -0.360238 ] [ 0.0081383 -0.2481453 -0.0746775 ] [ -0.1349841 0.2625027 0.0392768 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.413556691977985e-11 2.991909428211782e-10 7.520745232164864e-10 ] [ 3.795460284077952e-11 -1.305549641225088e-11 -7.212422363258111e-11 ] [ 5.833156575710016e-11 1.462604606655629e-10 -4.60673843778624e-11 ] [ 2.010787735285728e-10 -4.553989976899641e-10 -5.771649015237505e-10 ] [ 1.303899399305664e-11 -3.975725982214022e-10 -1.19646544599792e-10 ] [ -2.162683691997293e-10 4.205756888368761e-10 6.292837069983745e-11 ] ] } "relaxed-potential-energy" { "source-value" -12.39797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.986373767937978e-18 } }