{ "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" [ 5.43182 0 0 ] "si-unit" "m" "si-value" [ 5.43182e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00436542 5.42411 0 ] "si-unit" "m" "si-value" [ -4.36542e-13 5.42411e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.250705 -0.013062 5.36378 ] "si-unit" "m" "si-value" [ 2.50705e-11 -1.3062e-12 5.36378e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00336868 -0.0347308 0.0739509 ] [ 1.33721 1.36002 1.29514 ] [ 0.0804819 2.71297 2.74807 ] [ 1.4297 4.00589 4.14244 ] [ 2.76212 -0.0429027 2.66501 ] [ 4.31635 1.33651 3.99144 ] [ 2.62716 2.67896 0.144482 ] [ 3.97118 3.97277 1.25678 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.36868e-13 -3.47308e-12 7.395090000000001e-12 ] [ 1.33721e-10 1.36002e-10 1.29514e-10 ] [ 8.04819e-12 2.71297e-10 2.74807e-10 ] [ 1.4297e-10 4.00589e-10 4.14244e-10 ] [ 2.76212e-10 -4.29027e-12 2.66501e-10 ] [ 4.31635e-10 1.33651e-10 3.99144e-10 ] [ 2.62716e-10 2.67896e-10 1.44482e-11 ] [ 3.97118e-10 3.97277e-10 1.25678e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0958924 0.6869891 -0.9248158 ] [ -0.2300294 -1.4631538 3.1233422 ] [ 0.0906921 0.669424 -1.7527422 ] [ 1.8893961 -0.3167741 -1.1718044 ] [ -0.1337418 0.4208265 0.4191317 ] [ -2.0181296 -1.5467908 1.7655548 ] [ 0.1095713 -0.2001619 -4.4955378 ] [ 2.3881338 1.7496409 3.0368714 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.357989802992402e-09 1.100677874764433e-09 -1.481718253306449e-09 ] [ -3.685477267766515e-10 -2.344230810994679e-09 5.004145851598038e-09 ] [ 1.453047623112557e-10 1.072535482202419e-09 -2.808202575129557e-09 ] [ 3.027146258850699e-09 -5.075280570949613e-10 -1.877437613830572e-09 ] [ -2.142779851837094e-10 6.742383797130911e-10 6.715230107761594e-10 ] [ -3.233400062864456e-09 -2.478232057028528e-09 2.82873062330122e-09 ] [ 1.75552575170663e-10 -3.206947165549075e-10 -7.202645561082666e-09 ] [ 3.826212141702263e-09 2.803233744775471e-09 4.865604357456165e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.67333 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.875715193288327e-18 } }