{ "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" [ [ 0.0450915 0.6744384 2.108849 ] [ 0.1091138 2.224666 0.3426204 ] [ 1.10319 2.788623 2.698849 ] [ 2.780637 1.123883 1.270131 ] [ 2.821139 0.9081744 2.973557 ] [ 2.438974 2.484533 0.05951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.50915e-12 6.744384e-11 2.108849e-10 ] [ 1.091138e-11 2.224666e-10 3.426204e-11 ] [ 1.10319e-10 2.788623e-10 2.698849e-10 ] [ 2.780637e-10 1.123883e-10 1.270131e-10 ] [ 2.821139e-10 9.081744000000001e-11 2.973557e-10 ] [ 2.438974e-10 2.484533e-10 5.951e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7298462 -2.7110115 1.4565813 ] [ -0.8432315 1.1438759 -2.5556971 ] [ 2.469282 1.4407638 -0.864648 ] [ 0.5283072 -4.5946739 -20.9604338 ] [ -0.7141909 -5.4546756 31.1929907 ] [ -3.1700131 10.1757212 -8.2687931 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.77151916205369e-09 -4.343519279805291e-09 2.333700524381344e-09 ] [ -1.351005806352771e-09 1.83269123917572e-09 -4.094678177201561e-09 ] [ 3.956225923156788e-09 2.308358095473049e-09 -1.385318822234832e-09 ] [ 8.464414514139646e-10 -7.361479163429652e-09 -3.358231727286383e-08 ] [ -1.14425997219543e-09 -8.73935379236993e-09 4.997668084411929e-08 ] [ -5.078920918293905e-09 1.630330274073844e-08 -1.324806709620042e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.1487503 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.145356069296049e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2094854 0.8795396 1.7958006 ] [ -0.18328 2.2775774 -0.2658799 ] [ 1.1436083 2.6455623 3.3284577 ] [ 2.672845 0.5881117 1.3389429 ] [ 3.1976471 1.2211379 3.1415974 ] [ 2.2578395 2.5923889 0.1145978 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.094854e-11 8.795396e-11 1.7958006e-10 ] [ -1.8328e-11 2.2775774e-10 -2.658799e-11 ] [ 1.1436083e-10 2.6455623e-10 3.3284577e-10 ] [ 2.672845e-10 5.881117e-11 1.3389429e-10 ] [ 3.1976471e-10 1.2211379e-10 3.1415974e-10 ] [ 2.2578395e-10 2.5923889e-10 1.145978e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.5e-06 -3.24e-05 -6.81e-05 ] [ -4.78e-05 3.31e-05 3.56e-05 ] [ -1.5e-06 7e-06 -2.86e-05 ] [ -2.53e-05 -1.79e-05 -8e-06 ] [ 5.42e-05 3.6e-05 5.64e-05 ] [ 2.79e-05 -2.57e-05 1.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.2016324755e-14 -5.19105229416e-14 -1.091082287754e-13 ] [ -7.65840431052e-14 5.303204658539999e-14 5.703748817039999e-14 ] [ -2.403264951e-15 1.1215236438e-14 -4.58222517324e-14 ] [ -4.053506884019999e-14 -2.86789617486e-14 -1.2817413072e-14 ] [ 8.68379735628e-14 5.7678358824e-14 9.03627621576e-14 ] [ 4.470072808859999e-14 -4.11759394938e-14 2.01874255884e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.606665 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.340245736366561e-18 } }