{ "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" [ [ 2.70835 3.598 3.116557 ] [ 5.398567 2.472121 1.998263 ] [ 3.170959 1.761622 1.993892 ] [ 5.798068 2.225895 4.322659 ] [ 3.522139 1.857386 4.354431 ] [ 3.141461 3.938126 0.8725825 ] [ 4.820562 4.158888 3.263025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70835e-10 3.598e-10 3.116557e-10 ] [ 5.398567e-10 2.472121e-10 1.998263e-10 ] [ 3.170959e-10 1.761622e-10 1.993892e-10 ] [ 5.798068e-10 2.225895e-10 4.322659e-10 ] [ 3.522139e-10 1.857386e-10 4.354431e-10 ] [ 3.141461e-10 3.938126e-10 8.725825e-11 ] [ 4.820562e-10 4.158888e-10 3.263025e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.6632476 4.436418 2.5238453 ] [ 2.0273788 -3.1328074 -4.0264821 ] [ -1.6022787 -4.9232447 -3.7170234 ] [ 2.5160555 -0.4036034 1.8640827 ] [ 0.3757995 -1.8412717 2.2078569 ] [ 1.5006074 0.4985883 -1.4922439 ] [ 1.8456851 5.3659208 2.6399645 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.067569961127658e-08 7.10792525825701e-09 4.04364596749072e-09 ] [ 3.248218941626959e-09 -5.019310815102291e-09 -6.451135537839251e-09 ] [ -2.567133494295896e-09 -7.887907621804338e-09 -5.955328039511235e-09 ] [ 4.031165331947186e-09 -6.466439368829556e-10 2.986589745783631e-09 ] [ 6.02097177968883e-10 -2.950042494585458e-09 3.537376736395674e-09 ] [ 2.404238113087492e-09 7.988265242457821e-10 -2.390838308809032e-09 ] [ 2.957113540941953e-09 8.597152925654586e-09 4.229689436489493e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.569058 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.654655757499077e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.248685 3.6811204 3.167486 ] [ 5.2692054 2.1282462 1.9814448 ] [ 2.8054959 1.6593056 1.8115496 ] [ 6.1304379 2.4719019 4.2648651 ] [ 3.736659 1.9005043 4.1339151 ] [ 3.6917442 3.8955614 1.1406882 ] [ 4.6778788 4.2753983 3.4214607 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.248685e-10 3.6811204e-10 3.167486e-10 ] [ 5.2692054e-10 2.1282462e-10 1.9814448e-10 ] [ 2.8054959e-10 1.6593056e-10 1.8115496e-10 ] [ 6.130437900000001e-10 2.4719019e-10 4.2648651e-10 ] [ 3.736659e-10 1.9005043e-10 4.133915100000001e-10 ] [ 3.6917442e-10 3.8955614e-10 1.1406882e-10 ] [ 4.677878800000001e-10 4.2753983e-10 3.4214607e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.51e-05 -1.44e-05 -2.1e-06 ] [ -2.89e-05 -1.43e-05 1.8e-05 ] [ -1.56e-05 2.14e-05 -1.46e-05 ] [ -6.4e-06 3.32e-05 -9.7e-06 ] [ 1.82e-05 -7e-07 -2.22e-05 ] [ 1.98e-05 -1.94e-05 2.5e-05 ] [ -2.3e-06 -5.8e-06 5.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.41928671734e-14 -2.30713435296e-14 -3.364570931399999e-15 ] [ -4.63029047226e-14 -2.29111258662e-14 2.8839179412e-14 ] [ -2.49939554904e-14 3.42865799676e-14 -2.33917788564e-14 ] [ -1.02539304576e-14 5.31922642488e-14 -1.55411133498e-14 ] [ 2.915961473879999e-14 -1.1215236438e-15 -3.55683212748e-14 ] [ 3.17230973532e-14 -3.10822266996e-14 4.005441585e-14 ] [ -3.685006258199999e-15 -9.2926244772e-15 8.972189150399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.073267 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.536527262344328e-18 } }