{ "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" [ [ -3.5466243 3.5807624 1.1309722 ] [ 0.3614814 -1.2598623 -0.6406341 ] [ -0.5472908 1.765177 -1.3294884 ] [ 1.001946 -1.2527185 0.0591189 ] [ 0.0979905 -0.0545976 -1.9010759 ] [ 2.6607934 -1.0228852 0.6600434 ] [ -0.3014666 0.5437309 1.4188354 ] [ 0.2731703 -2.2996067 0.6022285 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.682318536221166e-09 5.737013801919697e-09 1.812017217614742e-09 ] [ 5.791570479340531e-10 -2.018521922487316e-09 -1.026408977507249e-09 ] [ -8.768565245389286e-10 2.828125320973882e-09 -2.130075232104799e-09 ] [ 1.605294456504077e-09 -2.007076293143645e-09 9.471891942741313e-11 ] [ 1.569980881605024e-10 -8.747499827179008e-11 -3.045859361346319e-09 ] [ 4.263060978258943e-09 -1.638842753202332e-09 1.057506104193343e-09 ] [ -4.830027384720653e-10 8.711529359865428e-10 2.273224906643416e-09 ] [ 4.376670681569222e-10 -3.68437609177504e-09 9.648764230794529e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -218.12563 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.494757847832711e-17 } }