{ "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" [ [ 2.700341 1.969723 2.203994 ] [ 1.820171 2.226461 4.644887 ] [ 1.683397 4.142957 3.874532 ] [ 4.686676 2.237231 1.35428 ] [ 4.257123 2.593073 3.820407 ] [ 3.357584 4.187851 2.029918 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700341e-10 1.969723e-10 2.203994e-10 ] [ 1.820171e-10 2.226461e-10 4.644887e-10 ] [ 1.683397e-10 4.142957e-10 3.874532e-10 ] [ 4.686676000000001e-10 2.237231e-10 1.35428e-10 ] [ 4.257123e-10 2.593073e-10 3.820407e-10 ] [ 3.357584e-10 4.187851e-10 2.029918e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.879967 -4.7580274 -0.7163731 ] [ 0.3294624 -7.3548621 3.3634517 ] [ -0.0649325 7.1912438 -3.4817783 ] [ 5.4138409 -0.7494175 -3.2919742 ] [ 2.7495371 0.545979 4.3151397 ] [ -0.5479409 5.1250843 -0.1884658 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.262509890007551e-08 -7.623200261405808e-09 -1.147756232590021e-09 ] [ 5.27856954712658e-10 -1.178378810582799e-08 5.388843678930016e-09 ] [ -1.04033333430096e-10 1.152164269083295e-08 -5.578423791068769e-09 ] [ 8.673929318710831e-09 -1.200699197718384e-09 -5.274324099516784e-09 ] [ 4.405244059642231e-09 8.747547892477632e-10 6.913615942825925e-09 ] [ -8.778980995601107e-10 8.211290245089134e-09 -3.019554985803686e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4540512 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.514705980448619e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4605695 1.6791179 2.1302075 ] [ 1.9371506 2.1843249 4.5865985 ] [ 1.5800707 4.4803899 3.8649784 ] [ 4.8705574 2.2826297 1.3287419 ] [ 4.3757306 2.5269557 3.8802188 ] [ 3.2812133 4.2038779 2.1372728 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4605695e-10 1.6791179e-10 2.1302075e-10 ] [ 1.9371506e-10 2.1843249e-10 4.5865985e-10 ] [ 1.5800707e-10 4.4803899e-10 3.8649784e-10 ] [ 4.8705574e-10 2.2826297e-10 1.3287419e-10 ] [ 4.3757306e-10 2.5269557e-10 3.8802188e-10 ] [ 3.2812133e-10 4.2038779e-10 2.1372728e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.6e-05 6.9e-06 -2.4e-06 ] [ -9.6e-06 -3.27e-05 1.15e-05 ] [ 1.84e-05 2.87e-05 -1.8e-05 ] [ -1.42e-05 -2.2e-06 -5.4e-06 ] [ -2.5e-06 3.7e-06 6.3e-06 ] [ -1.82e-05 -4.3e-06 8.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.16565921408e-14 1.105501868352e-14 -3.84522388992e-15 ] [ -1.538089555968e-14 -5.239117550016001e-14 1.84250311392e-14 ] [ 2.948004982272e-14 4.598246901696e-14 -2.88391791744e-14 ] [ -2.275090801536e-14 -3.52478856576e-15 -8.65175375232e-15 ] [ -4.005441552e-15 5.928053496960001e-15 1.009371271104e-14 ] [ -2.915961449856e-14 -6.889359469440001e-15 1.297763062848e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.587485 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.176955080247069e-18 } }