{ "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" [ [ 0.6660422 0.1321237 2.521111 ] [ 1.154832 2.450071 0.6217319 ] [ 0.2052378 1.707228 1.69737 ] [ 2.767871 1.123615 2.427941 ] [ 1.781428 1.004966 1.555643 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.660422e-11 1.321237e-11 2.521111e-10 ] [ 1.154832e-10 2.450071e-10 6.217319e-11 ] [ 2.052378e-11 1.707228e-10 1.69737e-10 ] [ 2.767871e-10 1.123615e-10 2.427941e-10 ] [ 1.781428e-10 1.004966e-10 1.555643e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.3291189 -27.6450737 19.9451073 ] [ 4.717344 28.762902 -28.8950197 ] [ -44.7025687 12.6358819 8.1263882 ] [ 64.7745903 4.5280651 47.591277 ] [ -8.4602468 -18.2817753 -46.7677528 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.616213253984341e-08 -4.429229076243295e-08 3.195558461540741e-08 ] [ 7.558018269071154e-09 4.608324913076156e-08 -4.629492502089543e-08 ] [ -7.162141046084585e-08 2.024491456336988e-08 1.301990918558499e-08 ] [ 1.037803342005585e-07 7.254760040680414e-09 7.624963136341676e-08 ] [ -1.355480962915801e-08 -2.929063297237891e-08 -7.493020014351373e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 38.795981 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.215801373920101e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2782991 0.0520911 2.4598022 ] [ 1.1132809 2.56196 0.581668 ] [ -0.7701272 1.9642736 1.7473432 ] [ 3.7915186 1.1889403 2.7392404 ] [ 2.1624396 0.6507387 1.2957431 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.782991e-11 5.209110000000001e-12 2.4598022e-10 ] [ 1.1132809e-10 2.56196e-10 5.81668e-11 ] [ -7.701272000000001e-11 1.9642736e-10 1.7473432e-10 ] [ 3.7915186e-10 1.1889403e-10 2.7392404e-10 ] [ 2.1624396e-10 6.507387e-11 1.2957431e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.3e-06 -7.1e-06 4.5e-06 ] [ -1.19e-05 -6.5e-06 1.2e-05 ] [ -3.1e-06 1.76e-05 -8.6e-06 ] [ 5.4e-06 5.3e-06 5.6e-06 ] [ 1.09e-05 -9.3e-06 -1.35e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.08282960704e-15 -1.137545400768e-14 7.2097947936e-15 ] [ -1.906590178752e-14 -1.04141480352e-14 1.92261194496e-14 ] [ -4.96674752448e-15 2.819830852608e-14 -1.377871893888e-14 ] [ 8.65175375232e-15 8.491536090240001e-15 8.972189076479999e-15 ] [ 1.746372516672e-14 -1.490024257344e-14 -2.16293843808e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.3903059 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.34427519543403e-18 } }