{ "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" [ [ 0.4161411 1.1488422 0.3540706 ] [ -1.0794282 0.1228756 -1.6551574 ] [ 1.4065138 1.247241 -1.2662035 ] [ -0.6179058 -1.3088427 1.655399 ] [ 0.0664322 1.4123561 1.176694 ] [ -0.1014744 -2.1784873 1.0059604 ] [ -1.5175224 0.111519 -0.7901358 ] [ 1.4272436 -0.5555039 -0.4806274 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.667315468670574e-10 1.840648128993155e-09 5.672836421063604e-10 ] [ -1.729434640120678e-09 1.968684152087304e-10 -2.651854511872191e-09 ] [ 2.253483545758549e-09 1.998300387166794e-09 -2.028681661589019e-09 ] [ -9.89994234773077e-10 -2.096997191521472e-09 2.652241597746966e-09 ] [ 1.064361185852148e-10 2.262843942307367e-09 1.885271632167996e-09 ] [ -1.625799126291696e-10 -3.490321449525748e-09 1.611726247609293e-09 ] [ -2.431338930851601e-09 1.78673136047046e-10 -1.265937116446897e-09 ] [ 2.286696346946042e-09 -8.900153686758726e-10 -7.700499899401715e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.272581 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.811508173307235e-18 } }