{ "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" [ [ 0.8670835 0.0748596 0.0624467 ] [ 1.077368 0.92169 1.864842 ] [ 2.976718 2.979813 0.7013645 ] [ 1.541867 2.360612 1.695051 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.670835000000001e-11 7.48596e-12 6.24467e-12 ] [ 1.077368e-10 9.216900000000001e-11 1.864842e-10 ] [ 2.976718e-10 2.979813e-10 7.013645e-11 ] [ 1.541867e-10 2.360612e-10 1.695051e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4346614 -2.0829467 -5.151721 ] [ -5.6674424 -17.7689934 7.613486 ] [ 7.7122059 2.9722416 -5.4751366 ] [ -1.6101022 16.8796985 3.0133716 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.964043330441972e-10 -3.337248505112511e-09 -8.253966943084397e-09 ] [ -9.08024371301064e-09 -2.84690658006295e-08 1.219814927198811e-08 ] [ 1.235631598777582e-08 4.762056002889185e-09 -8.772135856206401e-09 ] [ -2.579668101938646e-09 2.704425830285283e-08 4.82795352730269e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 6.78092647967288 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.086424187309554e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0280743 0.9822865 -0.1111618 ] [ 1.6551546 0.5975356 2.1550093 ] [ 2.9718371 2.0317849 0.7816616 ] [ 0.8079705 2.7253675 1.4981951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0280743e-10 9.822865e-11 -1.111618e-11 ] [ 1.6551546e-10 5.975356e-11 2.1550093e-10 ] [ 2.9718371e-10 2.0317849e-10 7.816615999999999e-11 ] [ 8.079705000000001e-11 2.7253675e-10 1.4981951e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.09e-05 1e-07 -1.05e-05 ] [ 9.1e-06 -7.1e-06 9.1e-06 ] [ 1.2e-05 -1.3e-06 4.4e-06 ] [ -1.02e-05 8.3e-06 -2.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.746372516672e-14 1.6021766208e-16 -1.68228545184e-14 ] [ 1.457980724928e-14 -1.137545400768e-14 1.457980724928e-14 ] [ 1.92261194496e-14 -2.08282960704e-15 7.04957713152e-15 ] [ -1.634220153216e-14 1.329806595264e-14 -4.646312200320001e-15 ] ] } "relaxed-potential-energy" { "source-value" -4.0298336203271194 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.456505212201934e-19 } }