{ "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" [ [ 3.095423 1.998262 0.8352723 ] [ 3.003915 2.107064 3.861401 ] [ 2.921301 4.877628 0.9226955 ] [ 1.839297 3.508607 2.236053 ] [ 4.200263 0.9739816 2.537715 ] [ 4.333089 3.298954 2.357847 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.095423e-10 1.998262e-10 8.352723e-11 ] [ 3.003915e-10 2.107064e-10 3.861401e-10 ] [ 2.921301e-10 4.877627999999999e-10 9.226955000000001e-11 ] [ 1.839297e-10 3.508607e-10 2.236053e-10 ] [ 4.200263e-10 9.739816e-11 2.537715e-10 ] [ 4.333089e-10 3.298954000000001e-10 2.357847e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.301988 -16.4788102 -29.5599083 ] [ -7.6988403 -3.1622598 28.204144 ] [ -0.7886878 15.5697189 -6.5095388 ] [ -23.0577258 5.3195811 3.2067766 ] [ 7.2716143 -18.3310626 0.5085431 ] [ 28.5756275 17.0828326 4.1499834 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.89254459656215e-09 -2.640196444104058e-08 -4.736019399125187e-08 ] [ -1.233490193593286e-08 -5.066498720455684e-09 4.51880201264766e-08 ] [ -1.263617154270186e-09 2.494543961400789e-08 -1.042943087755049e-08 ] [ -3.694254920557697e-08 8.522908470869546e-09 5.137822496648513e-09 ] [ 1.165041042693496e-08 -2.936959993214126e-08 8.147758654891566e-10 ] [ 4.578320230518955e-08 2.736971500876008e-08 6.649006380188095e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 13.602458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.179354019301393e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6336305 1.39773 0.6707025 ] [ 2.5010353 2.1743835 3.9973051 ] [ 3.1947528 4.8822371 1.6361728 ] [ 1.5092111 3.2207711 1.9568696 ] [ 4.3528181 1.4541002 2.4826693 ] [ 5.2018402 3.6352747 2.0072645 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.633630500000001e-10 1.39773e-10 6.707025e-11 ] [ 2.5010353e-10 2.1743835e-10 3.9973051e-10 ] [ 3.1947528e-10 4.882237100000001e-10 1.6361728e-10 ] [ 1.5092111e-10 3.2207711e-10 1.9568696e-10 ] [ 4.352818100000001e-10 1.4541002e-10 2.4826693e-10 ] [ 5.201840200000001e-10 3.6352747e-10 2.0072645e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 2.75e-05 -1.38e-05 ] [ 2.54e-05 1.3e-05 -5.4e-06 ] [ 2.94e-05 8.9e-06 -2.65e-05 ] [ 1.31e-05 -4.7e-05 1.96e-05 ] [ -3.12e-05 -1.52e-05 7.6e-06 ] [ -3.66e-05 1.27e-05 1.85e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-16 4.4059857072e-14 -2.211003736704e-14 ] [ 4.069528616832e-14 2.08282960704e-14 -8.65175375232e-15 ] [ 4.710399265152e-14 1.425937192512e-14 -4.24576804512e-14 ] [ 2.098851373248e-14 -7.530230117759999e-14 3.140266176767999e-14 ] [ -4.998791056896e-14 -2.435308463616e-14 1.217654231808e-14 ] [ -5.863966432128e-14 2.034764308416e-14 2.96402674848e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.132746 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.104097860810472e-18 } }