{ "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" [ [ 0.1365366 6.735067 -1.552754 ] [ -2.6955384 3.0631349 -9.0674981 ] [ -2.3185489 1.9462831 4.5447689 ] [ -1.0199188 1.3078241 -5.7416434 ] [ 8.037855 -8.6331026 6.4481249 ] [ 2.7071902 -3.0395578 -3.235567 ] [ -0.6773005 -2.3384371 4.8681957 ] [ -4.1702753 0.9587884 3.7363731 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.187557484035213e-10 1.079076688692159e-08 -2.487786156653683e-09 ] [ -4.318728604948639e-09 4.907683123136546e-09 -1.452773346496842e-08 ] [ -3.714724841761557e-09 3.118289280278149e-09 7.281522478518933e-09 ] [ -1.634090056474391e-09 2.095365197138801e-09 -9.199126820450624e-09 ] [ 1.287806336238038e-08 -1.38317551506877e-08 1.033103496277834e-08 ] [ 4.337396846498876e-09 -4.869908444730283e-09 -5.183949802431995e-09 ] [ -1.08515502635615e-09 -3.746589250831352e-09 7.79970933601909e-09 ] [ -6.681517587959707e-09 1.536148358774239e-09 5.98632962740602e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.981833 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.803619188132993e-18 } }