{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8070865 2.620947 2.881943 ] [ 2.981493 2.883992 2.450576 ] [ 2.14387 2.287305 4.61196 ] [ 1.117537 4.809867 2.516966 ] [ 2.97789 5.94727 2.412215 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.070865000000001e-11 2.620947e-10 2.881943e-10 ] [ 2.981493e-10 2.883992e-10 2.450576e-10 ] [ 2.14387e-10 2.287305e-10 4.61196e-10 ] [ 1.117537e-10 4.809867e-10 2.516966e-10 ] [ 2.97789e-10 5.947269999999999e-10 2.412215e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2984419 -1.0659315 -0.8832555 ] [ 1.2114975 0.7226076 -0.344665 ] [ 0.9579015 -0.191843 1.3519021 ] [ -1.305347 0.3029027 -0.0798856 ] [ 1.43439 0.2322642 -0.0440959 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.682509876447131e-09 -1.707810528674275e-09 -1.415131312293014e-09 ] [ 1.941032970657648e-09 1.157745002732398e-09 -5.522142050080319e-10 ] [ 1.534727388329251e-09 -3.073663694641344e-10 2.165985938230424e-09 ] [ -2.091396445431418e-09 4.853036243171962e-10 -1.279908406585805e-10 ] [ 2.298146123109312e-09 3.721282710888153e-10 -7.064942005313472e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -4.170105775408899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.681245979623195e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.898924 2.5396231 2.4302016 ] [ 3.2375309 2.7635688 2.2836726 ] [ 2.1208064 3.3866724 4.3194251 ] [ 0.7160077 4.8177745 2.9934908 ] [ 3.0546075 5.0417423 2.84687 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.98924e-11 2.5396231e-10 2.4302016e-10 ] [ 3.2375309e-10 2.7635688e-10 2.2836726e-10 ] [ 2.1208064e-10 3.3866724e-10 4.3194251e-10 ] [ 7.160077000000001e-11 4.8177745e-10 2.9934908e-10 ] [ 3.0546075e-10 5.041742300000001e-10 2.84687e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.26e-05 3e-06 1.12e-05 ] [ -3e-07 2.95e-05 2e-06 ] [ 4.6e-06 2.3e-06 -7e-06 ] [ 2.1e-06 -2.25e-05 -1.45e-05 ] [ 1.62e-05 -1.24e-05 8.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.620919163008e-14 4.8065298624e-15 1.794437815296e-14 ] [ -4.8065298624e-16 4.72642103136e-14 3.2043532416e-15 ] [ 7.370012455680001e-15 3.68500622784e-15 -1.12152363456e-14 ] [ 3.36457090368e-15 -3.604897396800001e-14 -2.32315610016e-14 ] [ 2.595526125696e-14 -1.986699009792e-14 1.329806595264e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.786807775408899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.271488126823796e-19 } }