{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.6136317 0.272403 0.5113261 ] [ 1.058649 2.716721 0.3297698 ] [ 0.0311528 1.744123 2.343307 ] [ 2.175185 1.227279 1.696033 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.136317e-11 2.72403e-11 5.113261e-11 ] [ 1.058649e-10 2.716721e-10 3.297698e-11 ] [ 3.11528e-12 1.744123e-10 2.343307e-10 ] [ 2.175185e-10 1.227279e-10 1.696033e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0521888 0.3894969 -0.5520304 ] [ -0.5979855 -0.8343599 0.4132053 ] [ -0.023577 0.1033161 -0.768465 ] [ 1.6737513 0.3415468 0.9072902 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.685792296027607e-09 6.240428270540756e-10 -8.844502008508725e-10 ] [ -9.580783876773984e-10 -1.336791925113026e-09 6.620278712506502e-10 ] [ -3.77745181886016e-11 1.655306399722349e-10 -1.231216656903072e-09 ] [ 2.681645201893607e-09 5.472182978690535e-10 1.453639146720956e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.393032 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.466235599362627e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5429615 0.3322 0.4735366 ] [ 1.0137243 2.636412 0.3458426 ] [ 0.0392603 1.7397038 2.2935717 ] [ 2.2826724 1.2522103 1.767485 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.429615e-11 3.322e-11 4.735366e-11 ] [ 1.0137243e-10 2.636412e-10 3.458426e-11 ] [ 3.92603e-12 1.7397038e-10 2.2935717e-10 ] [ 2.2826724e-10 1.2522103e-10 1.767485e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.5e-06 -2.1e-06 -5.3e-06 ] [ -3.2e-06 1.8e-06 -4.2e-06 ] [ -1.9e-06 4e-06 6.3e-06 ] [ 2.7e-06 -3.8e-06 3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.005441552e-15 -3.36457090368e-15 -8.491536090240001e-15 ] [ -5.126965186560001e-15 2.88391791744e-15 -6.72914180736e-15 ] [ -3.04413557952e-15 6.4087064832e-15 1.009371271104e-14 ] [ 4.32587687616e-15 -6.08827115904e-15 5.126965186560001e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.645677 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.506713790598828e-18 } }