{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.40034 0 0 ] "si-unit" "m" "si-value" [ 5.40034e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00680429 5.47714 0 ] "si-unit" "m" "si-value" [ -6.804290000000001e-13 5.477140000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0750519 0.000428382 5.30288 ] "si-unit" "m" "si-value" [ 7.50519e-12 4.28382e-14 5.30288e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0542923 -0.0551564 0.0107349 ] [ 1.38568 1.34449 1.49834 ] [ -0.0627007 2.68919 2.77312 ] [ 1.41517 4.13638 3.9375 ] [ 2.74489 -0.0643812 2.6522 ] [ 4.02561 1.44985 4.00224 ] [ 2.7219 2.73875 0.136559 ] [ 4.01026 4.10579 1.40939 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.429230000000001e-12 -5.51564e-12 1.07349e-12 ] [ 1.38568e-10 1.34449e-10 1.49834e-10 ] [ -6.27007e-12 2.68919e-10 2.77312e-10 ] [ 1.41517e-10 4.13638e-10 3.9375e-10 ] [ 2.74489e-10 -6.43812e-12 2.6522e-10 ] [ 4.025610000000001e-10 1.44985e-10 4.00224e-10 ] [ 2.7219e-10 2.73875e-10 1.36559e-11 ] [ 4.01026e-10 4.10579e-10 1.40939e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.351415 1.3676607 0.4103818 ] [ -1.4414935 0.3863511 -1.8690137 ] [ 2.8775542 2.7564551 -2.6238535 ] [ -1.0991673 -1.9952327 2.0740094 ] [ 0.2679158 2.5791208 1.747321 ] [ -1.458932 -3.9876766 1.9888383 ] [ -1.9911875 0.0135876 -1.0028028 ] [ 2.4938953 -1.120266 -0.7248807 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.630288971984319e-10 2.191233998726963e-09 6.575041255618214e-10 ] [ -2.309527184735165e-09 6.190026998403629e-10 -2.994490054094905e-09 ] [ 4.610350064324847e-09 4.416327917504927e-09 -4.203876734104253e-09 ] [ -1.76106015040786e-09 -3.19671518499566e-09 3.322929371999435e-09 ] [ 4.292484311029286e-10 4.132207047978993e-09 2.799516855232877e-09 ] [ -2.337466741736986e-09 -6.388962219831233e-09 3.186470226811617e-09 ] [ -3.1902340601292e-09 2.176973505278208e-11 -1.606667201432778e-09 ] [ 3.995660744383002e-09 -1.794863994277133e-09 -1.161386910409139e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.95503 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.760630846616263e-18 } }