{ "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" [ 5.47373 0 0 ] "si-unit" "m" "si-value" [ 5.47373e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.128217 5.8305 0 ] "si-unit" "m" "si-value" [ -1.28217e-11 5.8305e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.28854 -0.0943746 5.99929 ] "si-unit" "m" "si-value" [ 2.8854e-11 -9.437460000000001e-12 5.99929e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.153552 -0.151682 0.285368 ] [ 1.56659 1.11428 1.80298 ] [ 0.0114317 2.78427 2.63644 ] [ 1.58247 4.14354 3.67768 ] [ 2.87662 -0.0580046 2.88139 ] [ 4.22527 1.43863 4.17233 ] [ 2.56962 2.98931 0.105287 ] [ 4.06718 4.1162 1.17836 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.53552e-11 -1.51682e-11 2.85368e-11 ] [ 1.56659e-10 1.11428e-10 1.80298e-10 ] [ 1.14317e-12 2.78427e-10 2.63644e-10 ] [ 1.58247e-10 4.14354e-10 3.67768e-10 ] [ 2.87662e-10 -5.800460000000001e-12 2.88139e-10 ] [ 4.22527e-10 1.43863e-10 4.17233e-10 ] [ 2.56962e-10 2.98931e-10 1.05287e-11 ] [ 4.067179999999999e-10 4.1162e-10 1.17836e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.3143131 5.3738957 -1.1501465 ] [ -6.8972547 8.4737591 -10.1911985 ] [ -0.187418 -0.5558199 -0.1662546 ] [ -1.3811326 -2.7820428 2.2204426 ] [ 9.9756311 -5.229304 0.6161573 ] [ -2.9011437 2.8587628 4.4363581 ] [ -2.2799426 -10.0344597 -4.3967809 ] [ -0.6430527 1.8952088 8.6314226 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.912291583631172e-09 8.609930053157652e-09 -1.842737832794947e-09 ] [ -1.105062022804292e-08 1.357645872031125e-08 -1.632809997463203e-08 ] [ -3.002767379170944e-10 -8.90521649155394e-10 -2.663692332204557e-10 ] [ -2.212818361944718e-09 -4.45732393222497e-09 3.557541221548366e-09 ] [ 1.598272292614539e-08 -8.378268611855924e-09 9.87192820795252e-10 ] [ -4.648144609721209e-09 4.580242922572746e-09 7.107829229316708e-09 ] [ -3.652870730485966e-09 -1.607697673369978e-08 -7.044419564759983e-09 ] [ -1.030284001882316e-09 3.036459230894423e-09 1.382906349396475e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -26.182433 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.194888202826241e-18 } }