{ "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" [ [ 2.683716 2.607351 2.520111 ] [ 4.637842 1.301932 1.847927 ] [ 5.191502 3.374533 2.444496 ] [ 3.483741 4.863871 2.209214 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.683716e-10 2.607351e-10 2.520111e-10 ] [ 4.637842e-10 1.301932e-10 1.847927e-10 ] [ 5.191502e-10 3.374533e-10 2.444496e-10 ] [ 3.483741e-10 4.863871e-10 2.209214e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8808816 0.1325065 -0.2470344 ] [ -1.1235942 -1.3583533 -0.3534158 ] [ 1.3065692 1.0201716 0.7011868 ] [ -1.0638566 0.2056752 -0.1007367 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.411327905212897e-09 2.122988164040352e-10 -3.957927402133555e-10 ] [ -1.800196358506479e-09 -2.176321900046529e-09 -5.662345321813287e-10 ] [ 2.093354625697359e-09 1.63449508672413e-09 1.123425097773566e-09 ] [ -1.704486172403777e-09 3.295279969183641e-10 -1.613979855965433e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.7874845 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.568127884234238e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8050205 2.6217476 2.61105 ] [ 4.5539935 1.2809374 1.7273493 ] [ 5.2184133 3.3896535 2.5930714 ] [ 3.4193737 4.8553485 2.0902772 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8050205e-10 2.6217476e-10 2.61105e-10 ] [ 4.5539935e-10 1.2809374e-10 1.7273493e-10 ] [ 5.218413300000001e-10 3.3896535e-10 2.5930714e-10 ] [ 3.4193737e-10 4.8553485e-10 2.0902772e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.4e-06 1.3e-06 5.4e-06 ] [ 9.2e-06 -4.2e-06 -2.9e-06 ] [ -3e-06 -7.3e-06 -3e-07 ] [ -1.8e-06 1.01e-05 -2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.04957713152e-15 2.08282960704e-15 8.65175375232e-15 ] [ 1.474002491136e-14 -6.72914180736e-15 -4.646312200320001e-15 ] [ -4.8065298624e-15 -1.169588933184e-14 -4.8065298624e-16 ] [ -2.88391791744e-15 1.618198387008e-14 -3.68500622784e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.026357 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.606399477719443e-18 } }