{ "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" [ [ 0.2245113 0.4062398 2.51204 ] [ 0.3734712 1.938106 1.147246 ] [ 0.9603572 2.15083 2.976354 ] [ 2.053947 0.3264748 1.110732 ] [ 2.246066 2.745531 0.3277405 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.245113e-11 4.062398e-11 2.51204e-10 ] [ 3.734712e-11 1.938106e-10 1.147246e-10 ] [ 9.603572000000001e-11 2.15083e-10 2.976354000000001e-10 ] [ 2.053947e-10 3.264748e-11 1.110732e-10 ] [ 2.246066e-10 2.745531e-10 3.277405e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.3967395 -12.3998989 5.2789064 ] [ -7.3727593 7.8412539 -11.6479589 ] [ 2.05442 10.6913095 14.2635641 ] [ 7.8991715 -8.3777138 -5.1776092 ] [ 2.8159073 2.2450493 -2.7169024 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.646529855447882e-09 -1.986682811786364e-08 8.457740417471494e-09 ] [ -1.181246258124577e-08 1.256307367633682e-08 -1.866208742961929e-08 ] [ 3.291543693303936e-09 1.712936612663694e-08 2.285274893030219e-08 ] [ 1.265586790098967e-08 -1.342257718611353e-08 -8.295444411878992e-09 ] [ 4.511580842400053e-09 3.596965501003405e-09 -4.35295750627541e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 1.1412407 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.828469168245427e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0336501 0.0838635 2.8700819 ] [ 0.5622843 3.2747331 1.2087367 ] [ -0.0376565 2.0501757 2.9888211 ] [ 2.2956982 0.0931701 1.0166193 ] [ 2.0043765 2.0652391 -0.0101466 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0336501e-10 8.38635e-12 2.8700819e-10 ] [ 5.622843e-11 3.2747331e-10 1.2087367e-10 ] [ -3.765650000000001e-12 2.0501757e-10 2.9888211e-10 ] [ 2.2956982e-10 9.317010000000001e-12 1.0166193e-10 ] [ 2.0043765e-10 2.0652391e-10 -1.01466e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.3e-06 -1.01e-05 1.54e-05 ] [ 7.7e-06 2.3e-06 -1.28e-05 ] [ 5e-06 -1.29e-05 1.8e-06 ] [ -7.5e-06 6.3e-06 6.3e-06 ] [ 1e-07 1.43e-05 -1.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.491536090240001e-15 -1.618198387008e-14 2.467351996032e-14 ] [ 1.233675998016e-14 3.68500622784e-15 -2.050786074624e-14 ] [ 8.010883104e-15 -2.066807840832e-14 2.88391791744e-15 ] [ -1.2016324656e-14 1.009371271104e-14 1.009371271104e-14 ] [ 1.6021766208e-16 2.291112567744e-14 -1.730350750464e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.9680601 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.436841622614931e-18 } }