{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.384535 1.809355 2.901981 ] [ 1.948299 3.967012 2.633856 ] [ 1.645033 3.274995 4.707865 ] [ 4.440095 1.758867 2.666287 ] [ 3.649735 2.240012 5.07701 ] [ 4.164388 4.024114 1.736165 ] [ 3.303688 4.596831 4.046686 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.384535e-10 1.809355e-10 2.901981e-10 ] [ 1.948299e-10 3.967012e-10 2.633856000000001e-10 ] [ 1.645033e-10 3.274995e-10 4.707865e-10 ] [ 4.440095e-10 1.758867e-10 2.666287e-10 ] [ 3.649735e-10 2.240012e-10 5.07701e-10 ] [ 4.164388e-10 4.024114e-10 1.736165e-10 ] [ 3.303688e-10 4.596831e-10 4.046686e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8828081 -7.727941 -5.9435817 ] [ -5.5662056 3.0661329 -11.2569327 ] [ -9.4179531 -2.5401895 11.1058203 ] [ 0.521199 -1.2363533 -1.1367217 ] [ 4.4807566 -2.898722 5.3242967 ] [ 2.7140291 0.0802722 -2.9934777 ] [ 8.1509822 11.2568007 4.9005968 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.414414510125935e-09 -1.238152649913059e-08 -9.522667722009996e-09 ] [ -8.918044552359949e-09 4.912486489118658e-09 -1.803559454245053e-08 ] [ -1.508922439692786e-08 -4.069832262832143e-09 1.779348578606287e-08 ] [ 8.350528594641659e-10 -1.980856368628792e-09 -1.821228947100758e-09 ] [ 7.178963527161284e-09 -4.644264656861747e-09 8.530463765223307e-09 ] [ 4.348354008016048e-09 1.286102431997748e-10 -4.796080025340062e-09 ] [ 1.305931322498991e-08 1.803538305513484e-08 7.85162168561517e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.9235293 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.269489350327438e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9573051 1.2122569 2.3738407 ] [ 1.6224816 3.7551884 2.2266196 ] [ 1.6024051 3.2542405 4.6177335 ] [ 4.3548392 1.797962 2.840927 ] [ 3.8763133 2.5068574 5.107155 ] [ 4.0088103 4.1563411 2.1179171 ] [ 4.1136185 4.9883397 4.4856571 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9573051e-10 1.2122569e-10 2.3738407e-10 ] [ 1.6224816e-10 3.7551884e-10 2.2266196e-10 ] [ 1.6024051e-10 3.2542405e-10 4.6177335e-10 ] [ 4.3548392e-10 1.797962e-10 2.840927e-10 ] [ 3.8763133e-10 2.5068574e-10 5.107155e-10 ] [ 4.008810300000001e-10 4.1563411e-10 2.1179171e-10 ] [ 4.1136185e-10 4.9883397e-10 4.4856571e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-06 2.34e-05 -1.54e-05 ] [ 4.6e-06 -3.13e-05 1.21e-05 ] [ -2.4e-06 -6.5e-06 8.7e-06 ] [ -1.71e-05 -5.2e-06 4.7e-06 ] [ 2.8e-06 6.88e-05 -1.79e-05 ] [ 1.12e-05 7e-06 3e-06 ] [ -2e-06 -5.62e-05 4.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.806529901999999e-15 3.749093323559999e-14 -2.46735201636e-14 ] [ 7.370012516399999e-15 -5.014812864419999e-14 1.93863372714e-14 ] [ -3.845223921599999e-15 -1.0414148121e-14 1.39389367158e-14 ] [ -2.73972204414e-14 -8.331318496799998e-15 7.530230179799999e-15 ] [ 4.486094575199999e-15 1.102297524192e-13 -2.86789617486e-14 ] [ 1.79443783008e-14 1.1215236438e-14 4.806529901999999e-15 ] [ -3.204353268e-15 -9.004232683079999e-14 7.690447843199998e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.714404 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.998378080803613e-18 } }