{ "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" [ [ 2.0145775 3.1092681 -3.1655363 ] [ -3.6000618 3.1180438 -5.3477974 ] [ -0.169281 -0.5689865 0.1317235 ] [ -0.9830431 -2.0216314 5.4122155 ] [ 3.7383995 -1.465643 -0.103523 ] [ 0.4266812 -0.1532032 3.6834609 ] [ -1.4609606 -2.5204657 -3.6337016 ] [ 0.0336883 0.5026178 3.0231585 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.227708971289713e-09 4.981596657619237e-09 -5.071748252153735e-09 ] [ -5.767934849395166e-09 4.995656878990391e-09 -8.568115967055026e-09 ] [ -2.712180605456447e-10 -9.116168678508191e-10 2.110443121099488e-10 ] [ -1.575008672058756e-09 -3.239010564955173e-09 8.671325140831383e-09 ] [ 5.98957627811041e-09 -2.348218949039174e-09 -1.658621303150784e-10 ] [ 6.83618643174889e-10 -2.454585852717466e-10 5.901554937610927e-09 ] [ -2.340716917229941e-09 -4.038231218068307e-09 -5.821831750483554e-09 ] [ 5.397460665449664e-11 8.052824883579303e-10 4.843633869672797e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.134072 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.468881213110391e-18 } }