{ "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" [ [ 0.3247182 0.2574581 0.2093782 ] [ 0.0650872 0.6230634 2.300965 ] [ 0.7071473 2.551012 0.1142943 ] [ 0.540381 2.928346 2.93806 ] [ 2.649535 1.391538 0.3805226 ] [ 1.868471 1.381011 2.58095 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.247182e-11 2.574581e-11 2.093782e-11 ] [ 6.50872e-12 6.230634000000001e-11 2.300965e-10 ] [ 7.071473000000001e-11 2.551012e-10 1.142943e-11 ] [ 5.40381e-11 2.928346e-10 2.93806e-10 ] [ 2.649535e-10 1.391538e-10 3.805226e-11 ] [ 1.868471e-10 1.381011e-10 2.58095e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.88255 -0.177107 -2.8944594 ] [ -8.8606146 -4.0372958 2.0515475 ] [ -1.1068768 1.8195316 2.9773013 ] [ -3.2465419 4.1389772 -3.3132128 ] [ 0.1473549 -0.6873925 -0.0982765 ] [ 12.1841284 -1.0567135 1.2770999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.41400097668704e-09 -2.837566947800256e-10 -4.637435180534795e-09 ] [ -1.419626955803914e-08 -6.468460942014033e-09 3.286941440960688e-09 ] [ -1.773412131065918e-09 2.915210990326817e-09 4.770162535937447e-09 ] [ -5.201533530627611e-09 6.631372503864246e-09 -5.308352087895307e-09 ] [ 2.360885757403219e-10 -1.101324192813264e-09 -1.574563106740512e-10 ] [ 1.952112566730531e-08 -1.693041664583741e-09 2.046139602206018e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.169244 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.270163147121068e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.300823 0.4243951 0.1571743 ] [ -5.95e-05 0.4556784 2.4871466 ] [ 0.6859567 2.8102764 0.1748813 ] [ 0.3850625 2.8415607 2.5048517 ] [ 2.5422207 1.2846111 0.4350721 ] [ 2.2413363 1.3159068 2.7650441 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.00823e-11 4.243951000000001e-11 1.571743e-11 ] [ -5.950000000000001e-15 4.556784e-11 2.4871466e-10 ] [ 6.859567e-11 2.8102764e-10 1.748813e-11 ] [ 3.850625e-11 2.8415607e-10 2.5048517e-10 ] [ 2.5422207e-10 1.2846111e-10 4.350721000000001e-11 ] [ 2.2413363e-10 1.3159068e-10 2.7650441e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.18e-05 -1.19e-05 -1.7e-06 ] [ -7.5e-06 -1.03e-05 8.6e-06 ] [ -1.13e-05 1.23e-05 -1.96e-05 ] [ 9e-06 9.7e-06 2e-06 ] [ 2.08e-05 1.36e-05 1.6e-06 ] [ 8e-07 -1.35e-05 9.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.890568412544e-14 -1.906590178752e-14 -2.72370025536e-15 ] [ -1.2016324656e-14 -1.650241919424e-14 1.377871893888e-14 ] [ -1.810459581504e-14 1.970677243584e-14 -3.140266176767999e-14 ] [ 1.44195895872e-14 1.554111322176e-14 3.2043532416e-15 ] [ 3.332527371264e-14 2.178960204288e-14 2.56348259328e-15 ] [ 1.28174129664e-15 -2.16293843808e-14 1.457980724928e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.482382 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.961204033709475e-18 } }