{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.441410000000001e-10 0.0 0.0 ] "source-value" [ 5.44141 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.87259e-12 5.36248e-10 0.0 ] "source-value" [ 0.0387259 5.36248 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.84794e-11 -3.14768e-13 5.51994e-10 ] "source-value" [ -0.184794 -0.00314768 5.51994 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 7.55273140665784e-09 8.25847867244857e-10 -1.975037407039845e-09 ] [ -1.14232421297486e-09 -1.989799541988572e-09 8.313617580853401e-10 ] [ 1.171849123742963e-09 6.829061552316193e-10 2.852836652302453e-09 ] [ -5.552220512870909e-09 -4.514875878838389e-09 5.330583410032541e-09 ] [ 2.878120281119973e-09 5.592287745803875e-09 -1.945502722994356e-09 ] [ -2.711465874465909e-09 1.357960042844698e-09 -2.999762817353958e-09 ] [ -9.350254693690176e-10 -1.018019019414768e-09 -4.91304448676273e-09 ] [ -1.261664581622417e-09 -9.363075311009817e-10 2.818565453512892e-09 ] ] "source-value" [ [ 4.7140442 0.5154537 -1.2327213999999997 ] [ -0.7129827 -1.2419352 0.5188951999999999 ] [ 0.7314107 0.4262365 1.7806005999999999 ] [ -3.4654235 -2.8179639 3.3270884999999994 ] [ 1.7963814 3.4904315 -1.2142872999999998 ] [ -1.6923639 0.847572 -1.8723046999999997 ] [ -0.583597 -0.6353975 -3.0664811999999997 ] [ -0.7874691 -0.5843972 1.7592101999999998 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.39299e-11 -1.33288e-12 1.35909e-12 ] [ 1.42253e-10 1.35934e-10 1.29237e-10 ] [ 1.99653e-12 2.64656e-10 2.62294e-10 ] [ 1.43068e-10 4.14401e-10 3.95964e-10 ] [ 2.73386e-10 -8.042870000000001e-12 2.7169e-10 ] [ 4.04879e-10 1.39288e-10 4.20461e-10 ] [ 2.827650000000001e-10 2.77065e-10 1.03593e-11 ] [ 4.1636e-10 4.04392e-10 1.34337e-10 ] ] "source-value" [ [ -0.139299 -0.0133288 0.0135909 ] [ 1.42253 1.35934 1.29237 ] [ 0.0199653 2.64656 2.62294 ] [ 1.43068 4.14401 3.95964 ] [ 2.73386 -0.0804287 2.7169 ] [ 4.04879 1.39288 4.20461 ] [ 2.82765 2.77065 0.103593 ] [ 4.1636 4.04392 1.34337 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.658648139043128e-18 "source-value" -35.318504 } }