{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.44038e-10 0.0 0.0 ] "source-value" [ 5.44038 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.77809e-12 5.34742e-10 0.0 ] "source-value" [ 0.0177809 5.34742 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.58508e-11 -2.16411e-11 5.459270000000001e-10 ] "source-value" [ 0.258508 -0.216411 5.45927 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.967370987762362e-08 3.277403218905846e-08 2.775153148165721e-08 ] [ 1.788006357904785e-09 -5.880258966184916e-09 -2.359704793016028e-09 ] [ -2.855400455331057e-09 7.623582700965194e-09 -2.015997533003583e-09 ] [ 2.892677721983627e-08 -3.368670344934343e-08 -2.670404875462125e-08 ] [ -2.862055416360874e-09 3.153933544431734e-09 -8.058442755682476e-09 ] [ 6.783591779817888e-09 -5.842565518133325e-09 6.046424068098987e-09 ] [ -3.344182885744996e-09 7.670704637994869e-09 4.176161802264668e-09 ] [ 1.236973117283944e-09 -5.812725138788589e-09 1.164076324084814e-09 ] ] "source-value" [ [ -18.5208731 20.4559421 17.3211437 ] [ 1.1159858 -3.670169 -1.4728119 ] [ -1.7822008 4.7582661 -1.2582867 ] [ 18.0546744 -21.0255867 -16.6673564 ] [ -1.7863545 1.9685305 -5.0296844 ] [ 4.233985 -3.6466426 3.7738811 ] [ -2.0872748 4.7876773 2.6065552 ] [ 0.7720579 -3.6280177 0.7265593 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.11666e-12 -4.851160000000001e-12 -8.44937e-12 ] [ 1.40892e-10 1.32935e-10 1.34318e-10 ] [ 2.51238e-11 2.67562e-10 2.78628e-10 ] [ 1.4893e-10 4.10816e-10 4.17197e-10 ] [ 2.79244e-10 -5.58727e-12 2.81547e-10 ] [ 4.182470000000001e-10 1.3542e-10 3.88471e-10 ] [ 2.61313e-10 2.71504e-10 -1.44964e-11 ] [ 4.08224e-10 4.0407e-10 1.29994e-10 ] ] "source-value" [ [ -0.0111666 -0.0485116 -0.0844937 ] [ 1.40892 1.32935 1.34318 ] [ 0.251238 2.67562 2.78628 ] [ 1.4893 4.10816 4.17197 ] [ 2.79244 -0.0558727 2.81547 ] [ 4.18247 1.3542 3.88471 ] [ 2.61313 2.71504 -0.144964 ] [ 4.08224 4.0407 1.29994 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.866772183995067e-18 "source-value" -30.376003 } }