{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0251564 0.6941165 0.4465085 ] [ 0.3172663 0.1337315 1.61278 ] [ 0.5869901 2.638721 0.7880578 ] [ 2.963349 2.149596 1.324349 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.51564e-12 6.941165e-11 4.465085e-11 ] [ 3.172663e-11 1.337315e-11 1.61278e-10 ] [ 5.869901e-11 2.638721e-10 7.880578e-11 ] [ 2.963349e-10 2.149596e-10 1.324349e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -21.8395882 33.6398012 -80.9706608 ] [ 17.8739704 -57.4186017 86.2501224 ] [ 4.8455675 23.1313943 -5.0691027 ] [ -0.8799497 0.6474061 -0.2103589 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.499087791022212e-08 5.389690345504516e-08 -1.297293007732997e-07 ] [ 2.863725773168763e-08 -9.199474200069268e-08 1.3818793078892e-07 ] [ 7.763455026969793e-09 3.706057945930079e-08 -8.121597901286311e-09 ] [ -1.409834848435309e-09 1.037258926129067e-09 -3.370321143339426e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 20.376962 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.26474923883059e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3123523 0.9111073 0.5306854 ] [ -0.0700418 -0.9205589 1.8924156 ] [ 1.1043549 2.7110725 0.3853106 ] [ 3.170801 2.914544 1.3632837 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.123523000000001e-11 9.111073e-11 5.306854e-11 ] [ -7.00418e-12 -9.205589e-11 1.8924156e-10 ] [ 1.1043549e-10 2.7110725e-10 3.853106e-11 ] [ 3.170801e-10 2.914544e-10 1.3632837e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.7e-06 4e-07 -6.3e-06 ] [ 8e-06 -3e-06 7.7e-06 ] [ 5.8e-06 1.49e-05 -2.7e-06 ] [ -9.1e-06 -1.23e-05 1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.530230179799999e-15 6.408706536e-16 -1.00937127942e-14 ] [ 1.2817413072e-14 -4.806529901999999e-15 1.23367600818e-14 ] [ 9.2926244772e-15 2.38724318466e-14 -4.3258769118e-15 ] [ -1.45798073694e-14 -1.97067725982e-14 2.0828296242e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.9966042 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.281197240058626e-18 } }