{ "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" [ 5.44038 0 0 ] "si-unit" "m" "si-value" [ 5.44038e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0177809 5.34742 0 ] "si-unit" "m" "si-value" [ 1.77809e-12 5.34742e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.258508 -0.216411 5.45927 ] "si-unit" "m" "si-value" [ 2.58508e-11 -2.16411e-11 5.459270000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0111666 -0.0485116 -0.0844937 ] [ 1.40892 1.32935 1.34318 ] [ 0.251238 2.67562 2.78628 ] [ 1.4893 4.10816 4.17197 ] [ 2.79244 -0.0558727 2.81547 ] [ 4.18247 1.3542 3.88471 ] [ 2.61313 2.71504 -0.144964 ] [ 4.08224 4.0407 1.29994 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.11666e-12 -4.851160000000001e-12 -8.44937e-12 ] [ 1.40892e-10 1.32935e-10 1.34318e-10 ] [ 2.51238e-11 2.67562e-10 2.78628e-10 ] [ 1.4893e-10 4.10816e-10 4.17197e-10 ] [ 2.79244e-10 -5.58727e-12 2.81547e-10 ] [ 4.182470000000001e-10 1.3542e-10 3.88471e-10 ] [ 2.61313e-10 2.71504e-10 -1.44964e-11 ] [ 4.08224e-10 4.0407e-10 1.29994e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2739751 4.2777609 6.0171942 ] [ -0.0221502 -0.4894351 -0.681489 ] [ 0.1252448 -0.1722016 0.3245069 ] [ 3.8109837 -5.5092646 -4.4322216 ] [ 0.2654847 0.5603938 -2.0818554 ] [ 0.1017368 0.4149706 0.1336772 ] [ 0.196035 1.1720972 1.6372319 ] [ -1.2033597 -0.2543211 -0.9170442 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.245486405517813e-09 6.853728559818809e-09 9.64060794948032e-09 ] [ -3.548853287842679e-11 -7.841614810794533e-10 -1.091865752128026e-09 ] [ 2.006642920900032e-10 -2.758973798574144e-10 5.199173727517746e-10 ] [ 6.105869036694865e-09 -8.826815012643356e-09 -7.101201884230094e-09 ] [ 4.253533830244998e-10 8.978498521984693e-10 -3.335500077246723e-09 ] [ 1.630003237779312e-10 6.648561991169603e-10 2.141744863385448e-10 ] [ 3.140826964461899e-10 1.877906746616825e-09 2.623134694619424e-09 ] [ -1.92799479363725e-09 -4.074673239531774e-10 -1.469266789585223e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -31.518867 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.049879223755367e-18 } }