{ "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" [ 5.39854 0 0 ] "si-unit" "m" "si-value" [ 5.39854e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0197648 5.43736 0 ] "si-unit" "m" "si-value" [ 1.97648e-12 5.43736e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0299081 -0.213673 5.1785 ] "si-unit" "m" "si-value" [ -2.99081e-12 -2.13673e-11 5.1785e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.157946 -0.285755 0.37808 ] [ 1.35651 1.53389 1.4884 ] [ 0.00292057 2.68505 2.57873 ] [ 1.38402 4.09726 4.02157 ] [ 2.45639 0.443756 2.59681 ] [ 4.09137 1.38211 4.21726 ] [ 2.67291 2.94824 -0.16912 ] [ 4.08439 3.99712 1.2513 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.57946e-11 -2.85755e-11 3.780800000000001e-11 ] [ 1.35651e-10 1.53389e-10 1.4884e-10 ] [ 2.92057e-13 2.68505e-10 2.57873e-10 ] [ 1.38402e-10 4.097260000000001e-10 4.02157e-10 ] [ 2.45639e-10 4.43756e-11 2.59681e-10 ] [ 4.091370000000001e-10 1.38211e-10 4.21726e-10 ] [ 2.67291e-10 2.94824e-10 -1.6912e-11 ] [ 4.08439e-10 3.99712e-10 1.2513e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0020087 5.4933074 -0.9572708 ] [ -1.7456568 1.9615007 -7.4599381 ] [ -2.3411492 1.6751841 3.9583643 ] [ -0.6734621 1.6289307 -4.9373546 ] [ 6.0733995 -6.6915826 5.306078 ] [ 2.5567648 -2.7122274 -2.4857912 ] [ -0.6448956 -1.9240676 3.7248649 ] [ -3.2270094 0.5689547 2.8510474 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.21829217820096e-12 8.801248687147634e-09 -1.533716895534513e-09 ] [ -2.796850512900541e-09 3.142670563222835e-09 -1.195213841643517e-08 ] [ -3.750934514044623e-09 2.683940800555889e-09 6.341998738069357e-09 ] [ -1.079005231614872e-09 2.609834684443379e-09 -7.910514108719335e-09 ] [ 9.73065868767841e-09 -1.072109719787208e-08 8.501274119741222e-09 ] [ 4.096388787444388e-09 -4.34546733057317e-09 -3.982676544830377e-09 ] [ -1.033236653176789e-09 -3.082696125558766e-09 5.96789145841853e-09 ] [ -5.170239015781835e-09 9.115659186342778e-10 4.567881489072627e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -30.939792 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.957101139481488e-18 } }