{ "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" [ 5.39854 0 0 ] "si-unit" "m" "si-value" [ 5.39854e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0197648 5.43736 0 ] "si-unit" "m" "si-value" [ 1.97648e-12 5.43736e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0299081 -0.213673 5.1785 ] "si-unit" "m" "si-value" [ -2.99081e-12 -2.13673e-11 5.1785e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.157946 -0.285755 0.37808 ] [ 1.35651 1.53389 1.4884 ] [ 0.00292057 2.68505 2.57873 ] [ 1.38402 4.09726 4.02157 ] [ 2.45639 0.443756 2.59681 ] [ 4.09137 1.38211 4.21726 ] [ 2.67291 2.94824 -0.16912 ] [ 4.08439 3.99712 1.2513 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.57946e-11 -2.85755e-11 3.780800000000001e-11 ] [ 1.35651e-10 1.53389e-10 1.4884e-10 ] [ 2.92057e-13 2.68505e-10 2.57873e-10 ] [ 1.38402e-10 4.097260000000001e-10 4.02157e-10 ] [ 2.45639e-10 4.43756e-11 2.59681e-10 ] [ 4.091370000000001e-10 1.38211e-10 4.21726e-10 ] [ 2.67291e-10 2.94824e-10 -1.6912e-11 ] [ 4.08439e-10 3.99712e-10 1.2513e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5716149 8.4231268 -2.4379528 ] [ -4.2249403 3.7644605 -10.853923 ] [ -2.6669284 2.1514556 4.8475749 ] [ -1.4162763 1.5814092 -5.9982005 ] [ 11.5179568 -11.8121785 6.6989709 ] [ 3.4006222 -4.4080858 -2.6398436 ] [ 0.1954446 -2.1400045 5.0282797 ] [ -6.2342637 2.4398168 5.3550944 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.158280364262466e-10 1.349533694417919e-08 -3.906031010954875e-09 ] [ -6.76910062870495e-09 6.031330652715956e-09 -1.738990181783518e-08 ] [ -4.272890367031005e-09 3.44701189140845e-09 7.766671236344885e-09 ] [ -2.269124795147974e-09 2.533696869032633e-09 -9.610176687147117e-09 ] [ 1.845380125638141e-08 -1.892519638933717e-08 1.073293464782595e-08 ] [ 5.448397429901674e-09 -7.062532069427197e-09 -4.229495733334442e-09 ] [ 3.131367713614764e-10 -3.428665206554853e-09 8.056192244556528e-09 ] [ -9.988391630334385e-09 3.90901746820065e-09 8.579807120544248e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.029874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.651098581076411e-18 } }