{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46856e-10 0.0 0.0 ] "source-value" [ 5.46856 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.09414e-11 5.47364e-10 0.0 ] "source-value" [ 0.109414 5.47364 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 8.53482e-12 1.88746e-11 5.50226e-10 ] "source-value" [ 0.0853482 0.188746 5.50226 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.96837649778781e-09 -2.9403422521477e-09 -2.046524445030334e-09 ] [ 1.982049493238438e-10 -2.203995816164621e-10 4.417561913938266e-09 ] [ 2.367569237176886e-09 -2.493179083159296e-09 -1.29562479792988e-09 ] [ -1.454590519198387e-09 1.051244157088608e-09 -1.399879552168971e-09 ] [ -1.181348428927686e-09 -7.038182451392871e-10 -3.560405432693371e-09 ] [ 1.354391354639528e-09 2.350690466694421e-09 2.056847589433473e-09 ] [ -8.005732106164128e-10 -2.548551749133103e-09 -2.785245306765438e-09 ] [ 2.484723115390038e-09 5.504356287412819e-09 4.613270191433918e-09 ] ] "source-value" [ [ -1.8527149 -1.8352173 -1.2773401 ] [ 0.1237098 -0.1375626 2.7572253 ] [ 1.4777205 -1.55612 -0.8086654 ] [ -0.907884 0.656135 -0.8737361 ] [ -0.7373397 -0.4392888 -2.2222303 ] [ 0.8453446 1.4671856 1.2837833 ] [ -0.4996785 -1.5906809 -1.7384134 ] [ 1.5508422 3.435549 2.8793768 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.11998e-11 5.98912e-13 -1.42628e-11 ] [ 1.42992e-10 1.39997e-10 1.14788e-10 ] [ 3.44059e-12 2.83471e-10 2.60329e-10 ] [ 1.5648e-10 4.17845e-10 4.01026e-10 ] [ 2.81953e-10 7.576710000000001e-13 2.62729e-10 ] [ 4.17997e-10 1.38562e-10 3.91338e-10 ] [ 2.81257e-10 2.67111e-10 -1.66315e-11 ] [ 4.15871e-10 3.96748e-10 1.06238e-10 ] ] "source-value" [ [ 0.111998 0.00598912 -0.142628 ] [ 1.42992 1.39997 1.14788 ] [ 0.0344059 2.83471 2.60329 ] [ 1.5648 4.17845 4.01026 ] [ 2.81953 0.00757671 2.62729 ] [ 4.17997 1.38562 3.91338 ] [ 2.81257 2.67111 -0.166315 ] [ 4.15871 3.96748 1.06238 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.749530806769698e-18 "source-value" -35.885749 } }