{ "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" [ [ 0.1860509 3.95381 2.613527 ] [ 1.567846 3.644648 0.7971861 ] [ 2.293743 3.741388 3.176886 ] [ 3.786148 2.787453 1.709706 ] [ 5.865671 2.396852 2.649651 ] [ 3.786965 2.496542 4.574471 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.860509e-11 3.95381e-10 2.613527e-10 ] [ 1.567846e-10 3.644648e-10 7.971861000000001e-11 ] [ 2.293743e-10 3.741388e-10 3.176886e-10 ] [ 3.786148e-10 2.787453e-10 1.709706e-10 ] [ 5.865671e-10 2.396852e-10 2.649651e-10 ] [ 3.786965e-10 2.496542e-10 4.574471e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5959993 -0.2507164 0.0773984 ] [ 0.3354171 -0.0933539 -0.9063308 ] [ 1.7344492 1.0044976 1.7446013 ] [ -0.3680007 -0.6212775 -1.4509523 ] [ -1.1486875 0.2960178 1.7199409 ] [ 1.042821 -0.3351676 -1.1846574 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.557072786340356e-09 -4.016919578405976e-10 1.240059079889856e-10 ] [ 5.373974402640414e-10 -1.495694372727726e-10 -1.452102030434527e-09 ] [ 2.778893981099993e-09 1.609382583629078e-09 2.795159438506024e-09 ] [ -5.896021228356437e-10 -9.95396293729935e-10 -2.324681872108558e-09 ] [ -1.840400272267875e-09 4.742728024080851e-10 2.75564912184093e-09 ] [ 1.670783439644514e-09 -5.369976971938583e-10 -1.898030405575192e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.128571719227608 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.943211421233968e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0432637 3.1679804 3.0984256 ] [ 2.1954828 2.5681433 1.1464145 ] [ 2.9385101 4.6890152 3.3910185 ] [ 4.003621 4.2041392 1.359225 ] [ 4.2520555 1.9707362 2.2847191 ] [ 3.0534907 2.4206788 4.2416244 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0432637e-10 3.1679804e-10 3.0984256e-10 ] [ 2.1954828e-10 2.5681433e-10 1.1464145e-10 ] [ 2.9385101e-10 4.689015200000001e-10 3.3910185e-10 ] [ 4.003621e-10 4.2041392e-10 1.359225e-10 ] [ 4.2520555e-10 1.9707362e-10 2.2847191e-10 ] [ 3.0534907e-10 2.4206788e-10 4.2416244e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9e-07 -6.6e-06 1.95e-05 ] [ 3.18e-05 6e-07 6.8e-06 ] [ 1.4e-05 -3.45e-05 8.4e-06 ] [ 5.3e-06 -1.35e-05 -2.67e-05 ] [ -2.23e-05 4.27e-05 -7.8e-06 ] [ -2.78e-05 1.13e-05 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.4419589706e-15 -1.05743657844e-14 3.1242444363e-14 ] [ 5.09492169612e-14 9.613059803999998e-16 1.08948011112e-14 ] [ 2.243047287599999e-14 -5.527509387299999e-14 1.34582837256e-14 ] [ 8.4915361602e-15 -2.162938455899999e-14 -4.277811612779999e-14 ] [ -3.572853893819999e-14 6.84129422718e-14 -1.24969777452e-14 ] [ -4.454051042519999e-14 1.81045959642e-14 -1.602176634e-16 ] ] } "relaxed-potential-energy" { "source-value" -16.509304719227607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.64508222647324e-18 } }