{ "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" [ 5.29616 0 0 ] "si-unit" "m" "si-value" [ 5.29616e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.242438 5.47618 0 ] "si-unit" "m" "si-value" [ -2.42438e-11 5.47618e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.11809 -0.0034447 5.45685 ] "si-unit" "m" "si-value" [ 1.1809e-11 -3.4447e-13 5.456850000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0183909 -0.0832388 -0.0590634 ] [ 1.37993 1.35458 1.33752 ] [ -0.123201 2.75975 2.68859 ] [ 1.45379 4.06883 4.12913 ] [ 2.80695 0.0674874 2.75473 ] [ 4.11558 1.36445 4.01895 ] [ 2.83757 2.84317 -0.0421665 ] [ 3.94058 4.22423 1.31424 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.83909e-12 -8.32388e-12 -5.90634e-12 ] [ 1.37993e-10 1.35458e-10 1.33752e-10 ] [ -1.23201e-11 2.75975e-10 2.68859e-10 ] [ 1.45379e-10 4.06883e-10 4.12913e-10 ] [ 2.80695e-10 6.748740000000001e-12 2.75473e-10 ] [ 4.11558e-10 1.36445e-10 4.01895e-10 ] [ 2.83757e-10 2.84317e-10 -4.21665e-12 ] [ 3.94058e-10 4.224230000000001e-10 1.31424e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3924992 1.9776683 -1.2799568 ] [ -0.2134877 0.4396399 -0.0170519 ] [ 2.299242 0.5060172 -0.7250749 ] [ -1.3147886 0.064059 -0.434564 ] [ -0.5556087 -0.3002609 -1.2901345 ] [ -0.050832800000000004 -0.2797505 1.5572735 ] [ -1.7771733 -1.3605877 -0.1483565 ] [ -0.7798501 -1.0467852 2.3378652 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.833206315103693e-09 3.168573940062502e-09 -2.050716877489411e-09 ] [ -3.420450045864018e-10 7.043807751540964e-10 -2.732015574530459e-11 ] [ 3.683791808311428e-09 8.107289342421046e-10 -1.161698062679886e-09 ] [ -2.106523573569572e-09 1.02633832997406e-10 -6.96248286777576e-10 ] [ -8.901832767871156e-10 -4.810709980838106e-10 -2.067023350617273e-09 ] [ -8.144312440079519e-11 -4.48209714449817e-10 2.495027214447399e-09 ] [ -2.847345535828672e-09 -2.179901821447802e-09 -2.37693317802021e-10 ] [ -1.249457608242563e-09 -1.677134788257017e-09 3.745672996881736e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.045459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.775119217160501e-18 } }