{ "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" [ [ 1.135722 0.0671856 0.8418581 ] [ 1.330168 2.113646 0.0657344 ] [ 0.0470942 1.897018 2.992181 ] [ 2.611886 0.9021473 0.0602941 ] [ 2.88133 0.1204436 1.620481 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.135722e-10 6.71856e-12 8.418581000000001e-11 ] [ 1.330168e-10 2.113646e-10 6.57344e-12 ] [ 4.70942e-12 1.897018e-10 2.992181e-10 ] [ 2.611886e-10 9.021473000000001e-11 6.02941e-12 ] [ 2.88133e-10 1.204436e-11 1.620481e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -58.5380793 -31.4405954 3.1937123 ] [ -27.573087 46.1505281 -2.4204054 ] [ 0.7799318 -0.8043468 -2.0125877 ] [ 44.4453361 4.7807779 -60.4631655 ] [ 40.8858983 -18.6863637 61.7024463 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.378834208099644e-08 -5.037338689391203e-08 5.116891180621396e-09 ] [ -4.417695535468441e-08 7.394129715939345e-08 -3.877916944738073e-09 ] [ 1.249588495778461e-09 -1.288705637975293e-09 -3.224520960249644e-09 ] [ 7.120927840301825e-08 7.65965058061732e-09 -9.687267018366114e-08 ] [ 6.550643037666646e-08 -2.993885504790579e-08 9.885821690802746e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 28.593225 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.581139660827408e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5666841 0.3746425 1.3726721 ] [ 1.0112555 1.9342609 -0.507645 ] [ -0.0196296 1.7445155 3.2510644 ] [ 3.5083569 1.3233803 -0.2420017 ] [ 2.9395332 -0.2763587 1.7064587 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.666841e-11 3.746425e-11 1.3726721e-10 ] [ 1.0112555e-10 1.9342609e-10 -5.07645e-11 ] [ -1.96296e-12 1.7445155e-10 3.2510644e-10 ] [ 3.5083569e-10 1.3233803e-10 -2.420017e-11 ] [ 2.9395332e-10 -2.763587e-11 1.7064587e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.4e-05 -2.37e-05 2.01e-05 ] [ 2.61e-05 -3e-06 4.81e-05 ] [ 1.09e-05 9e-07 -3.96e-05 ] [ 4.2e-06 8.6e-06 -2.52e-05 ] [ -7.2e-06 1.73e-05 -3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.44740051072e-14 -3.797158591296e-14 3.220375007808e-14 ] [ 4.181680980288e-14 -4.8065298624e-15 7.706469546047999e-14 ] [ 1.746372516672e-14 1.44195895872e-15 -6.344619418368e-14 ] [ 6.72914180736e-15 1.377871893888e-14 -4.037485084416e-14 ] [ -1.153567166976e-14 2.771765553984e-14 -5.44740051072e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196935810426e-18 } }