{ "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" [ [ -3.0113751 4.2165615 2.1681604 ] [ 0.2961534 -0.7987549 -0.2570459 ] [ -1.4338297 1.1118199 -1.2365927 ] [ 2.4549751 -3.9476792 -2.0880097 ] [ -0.1606038 1.0288741 -1.9592181 ] [ 1.346794 -1.4236906 1.7888914 ] [ 0.0298682 1.2545194 1.1479537 ] [ 0.4780179 -1.4416502 0.4358608 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.824754781679262e-09 6.75567625546538e-09 3.473775903024377e-09 ] [ 4.744900536504308e-10 -1.279746426529442e-09 -4.118329314524947e-10 ] [ -2.297248423548678e-09 1.781331850320194e-09 -1.981239913391948e-09 ] [ 3.933303709866142e-09 -6.324879320658448e-09 -3.345360325343622e-09 ] [ -2.57315653571639e-10 1.648438028766641e-09 -3.139013434868196e-09 ] [ 2.157801859833715e-09 -2.281003794572725e-09 2.866119978230181e-09 ] [ 4.785413174537856e-11 2.009961653020044e-09 1.839224579900857e-09 ] [ 7.658691037039123e-10 -2.309778245811644e-09 6.983259836831846e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.921839 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.352048130994165e-18 } }