{ "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" [ [ -1.7297654 5.9450227 -1.8450258 ] [ -1.263413 1.9243319 -6.1038758 ] [ -2.957351 1.2138481 3.7350332 ] [ -0.7260656 1.433 -3.9841884 ] [ 6.7359463 -7.0899791 4.1019035 ] [ 1.8058183 -2.4179969 -2.2393986 ] [ 0.9765853 -1.9869661 3.5245856 ] [ -2.841755 0.9787394 2.8109663 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.771389683348761e-09 9.524976380065291e-09 -2.956057201532816e-09 ] [ -2.02421077101479e-09 3.083119580839644e-09 -9.779487103026896e-09 ] [ -4.738198631699501e-09 1.944799047022501e-09 5.984182870951811e-09 ] [ -1.163285329487125e-09 2.2959190976064e-09 -6.383373507342559e-09 ] [ 1.079217568082426e-08 -1.135939875598062e-08 6.571973888477693e-09 ] [ 2.893239861672801e-09 -3.874058102346875e-09 -3.587912081572251e-09 ] [ 1.564662135876954e-09 -3.183470631742155e-09 5.647008646328341e-09 ] [ -4.552993423041505e-09 1.568113384535819e-09 4.50366448771668e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.684683 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.717316482325921e-18 } }