{ "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" [ 5.46402 0 0 ] "si-unit" "m" "si-value" [ 5.46402e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0122514 5.46447 0 ] "si-unit" "m" "si-value" [ 1.22514e-12 5.464470000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0384841 0.0769758 5.42124 ] "si-unit" "m" "si-value" [ -3.848410000000001e-12 7.69758e-12 5.42124e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.184284 -0.0140014 0.000758292 ] [ 1.32272 1.33713 1.35336 ] [ -0.167119 2.81332 2.70768 ] [ 1.35941 4.15239 4.11153 ] [ 2.7301 0.0328947 2.73301 ] [ 3.99842 1.37193 4.14824 ] [ 2.79546 2.80288 -0.167 ] [ 4.15007 4.1513 1.18971 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.84284e-11 -1.40014e-12 7.582920000000001e-14 ] [ 1.32272e-10 1.33713e-10 1.35336e-10 ] [ -1.67119e-11 2.81332e-10 2.70768e-10 ] [ 1.35941e-10 4.15239e-10 4.11153e-10 ] [ 2.7301e-10 3.28947e-12 2.73301e-10 ] [ 3.99842e-10 1.37193e-10 4.148240000000001e-10 ] [ 2.79546e-10 2.80288e-10 -1.67e-11 ] [ 4.150070000000001e-10 4.1513e-10 1.18971e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3269513 1.1116365 -0.6896361 ] [ 0.8528624 3.4170042 1.4665522 ] [ 0.783025 -0.7037196 0.2450452 ] [ -1.5891909 -1.0923202 -2.7510281 ] [ 0.8397405 -0.7711188 -1.5009018 ] [ 1.4149217 -1.3656664 0.1329636 ] [ -0.7309556 -1.3203698 2.3575022 ] [ -1.2434519 0.724554 0.7395027 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.238337290001671e-10 1.781038011127939e-09 -1.104918836279691e-09 ] [ 1.366436198039378e-09 5.474644242415408e-09 2.349675648022806e-09 ] [ 1.25454434850192e-09 -1.127483090718728e-09 3.926056904792602e-10 ] [ -2.546164505968111e-09 -1.75008988686758e-09 -4.407632904983845e-09 ] [ 1.345412596638903e-09 -1.235468513219351e-09 -2.404709774076637e-09 ] [ 2.266954468002591e-09 -2.188038777892101e-09 2.130311713374029e-10 ] [ -1.171119973162837e-09 -2.115465624370372e-09 3.777134908324566e-09 ] [ -1.99222956326934e-09 1.160863479307123e-09 1.184813936958476e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -217.67477 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.487534274320172e-17 } }