{ "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" [ 5.41394 0 0 ] "si-unit" "m" "si-value" [ 5.413940000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0321649 5.43167 0 ] "si-unit" "m" "si-value" [ 3.216490000000001e-12 5.431670000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.034689 -0.0250046 5.52467 ] "si-unit" "m" "si-value" [ -3.4689e-12 -2.50046e-12 5.52467e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0104706 0.0216981 0.0176006 ] [ 1.39448 1.38403 1.49781 ] [ 0.0179868 2.6904 2.7801 ] [ 1.33759 4.02716 4.17727 ] [ 2.6683 -0.0231463 2.83015 ] [ 4.02805 1.42643 4.22871 ] [ 2.71964 2.8128 -0.0574889 ] [ 4.09713 4.0529 1.34951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04706e-12 2.16981e-12 1.76006e-12 ] [ 1.39448e-10 1.38403e-10 1.49781e-10 ] [ 1.79868e-12 2.6904e-10 2.7801e-10 ] [ 1.33759e-10 4.02716e-10 4.17727e-10 ] [ 2.6683e-10 -2.31463e-12 2.83015e-10 ] [ 4.02805e-10 1.42643e-10 4.228710000000001e-10 ] [ 2.71964e-10 2.8128e-10 -5.74889e-12 ] [ 4.09713e-10 4.052900000000001e-10 1.34951e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5160665 -0.2848569 -0.3659495 ] [ 0.2923818 -0.0496635 1.3001506 ] [ 0.151026 -0.1765625 -0.2297884 ] [ 0.4557113 -0.8329683 0.7828205 ] [ -0.8748461 0.5494332 0.0982978 ] [ -0.044307 0.5039567 0.5527553 ] [ 0.042487 1.0469177 -1.1947705 ] [ 0.4936135 -0.7562565 -0.9435157 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.268296878901609e-10 -4.563910692136746e-10 -5.863157381239829e-10 ] [ 4.684472881668612e-10 -7.956969926265899e-11 2.08307091200108e-09 ] [ 2.41970328326484e-10 -2.82884311940625e-10 -3.681616052442456e-10 ] [ 7.301299967097641e-10 -1.334562347122702e-09 1.254216713716197e-09 ] [ -1.401657979766027e-09 8.802890349838487e-10 1.574904383336052e-10 ] [ -7.098764012263799e-11 8.074276492877478e-10 8.8561162597966e-10 ] [ 6.807167864875799e-11 1.677347076661022e-09 -1.914233378092497e-09 ] [ 7.908560159269588e-10 -1.211656493610621e-09 -1.511678808352154e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.0432756015624776 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.671511791645695e-19 } }