{ "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" [ 5.43182 0 0 ] "si-unit" "m" "si-value" [ 5.43182e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00436542 5.42411 0 ] "si-unit" "m" "si-value" [ -4.36542e-13 5.42411e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.250705 -0.013062 5.36378 ] "si-unit" "m" "si-value" [ 2.50705e-11 -1.3062e-12 5.36378e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00336868 -0.0347308 0.0739509 ] [ 1.33721 1.36002 1.29514 ] [ 0.0804819 2.71297 2.74807 ] [ 1.4297 4.00589 4.14244 ] [ 2.76212 -0.0429027 2.66501 ] [ 4.31635 1.33651 3.99144 ] [ 2.62716 2.67896 0.144482 ] [ 3.97118 3.97277 1.25678 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.36868e-13 -3.47308e-12 7.395090000000001e-12 ] [ 1.33721e-10 1.36002e-10 1.29514e-10 ] [ 8.04819e-12 2.71297e-10 2.74807e-10 ] [ 1.4297e-10 4.00589e-10 4.14244e-10 ] [ 2.76212e-10 -4.29027e-12 2.66501e-10 ] [ 4.31635e-10 1.33651e-10 3.99144e-10 ] [ 2.62716e-10 2.67896e-10 1.44482e-11 ] [ 3.97118e-10 3.97277e-10 1.25678e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6057584 1.2222529 0.5853271 ] [ -0.4342179 -1.5426999 1.5528237 ] [ -0.1753684 2.4024442 -1.218315 ] [ 1.6622358 -0.7755473 -1.2358041 ] [ 0.0666232 1.2160942 1.4609843 ] [ -1.8789444 -1.9926764 0.5586105 ] [ 0.7624009 -0.6173286 -2.8299073 ] [ 1.603029 0.087461 1.1262808 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.572708567133215e-09 1.958265021085e-09 9.377973951406636e-10 ] [ -6.956937677128723e-10 -2.471677712690498e-09 2.487897828364153e-09 ] [ -2.809711505071028e-10 3.84913993001656e-09 -1.951955809769952e-09 ] [ 2.663195337016785e-09 -1.242563752384564e-09 -1.979976436908785e-09 ] [ 1.067421334428826e-10 1.948397695930479e-09 2.340754888815854e-09 ] [ -3.010400789463084e-09 -3.192619540899909e-09 8.949926832333985e-10 ] [ 1.221500897656879e-09 -9.890694502711949e-10 -4.534011315091252e-09 ] [ 2.568335586264403e-09 1.401279694317888e-10 1.804500766215921e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -219.28105 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.513269716944758e-17 } }