{ "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" [ 5.59774 0 0 ] "si-unit" "m" "si-value" [ 5.597740000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.20689 5.51351 0 ] "si-unit" "m" "si-value" [ -2.0689e-11 5.513510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.513105 0.215809 5.94806 ] "si-unit" "m" "si-value" [ 5.131050000000001e-11 2.15809e-11 5.94806e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00246673 -0.00144352 -0.0330248 ] [ 1.48237 1.24989 1.2555 ] [ 0.11896 2.3805 2.33914 ] [ 1.62926 4.22989 4.16904 ] [ 2.92639 0.137476 2.28463 ] [ 4.54625 1.57381 3.68026 ] [ 3.00188 2.71108 0.0736878 ] [ 4.22934 4.27512 1.23802 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.46673e-13 -1.44352e-13 -3.30248e-12 ] [ 1.48237e-10 1.24989e-10 1.2555e-10 ] [ 1.1896e-11 2.3805e-10 2.33914e-10 ] [ 1.62926e-10 4.22989e-10 4.16904e-10 ] [ 2.92639e-10 1.37476e-11 2.28463e-10 ] [ 4.54625e-10 1.57381e-10 3.68026e-10 ] [ 3.00188e-10 2.71108e-10 7.36878e-12 ] [ 4.22934e-10 4.27512e-10 1.23802e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6310921 1.480684 -5.5817982 ] [ 0.5961667 0.1925058 -4.6081473 ] [ 2.137601 9.2818113 -0.9536413 ] [ 0.1327927 -0.6287408 0.1322389 ] [ 2.4093584 -1.9233149 5.7348445 ] [ -4.8684664 -4.4202766 7.7203205 ] [ -1.8949239 -0.6107073 -4.4483502 ] [ -0.1436206 -3.3719616 2.0045332 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.613297628991576e-09 2.372317287592627e-09 -8.943026578063522e-09 ] [ 9.551643488394875e-10 3.084282921284007e-10 -7.383065869262644e-09 ] [ 3.424814346798701e-09 1.487110106353725e-08 -1.527901795489319e-09 ] [ 2.127573593529082e-10 -1.007353810303089e-09 2.118700739403091e-10 ] [ 3.860217699608094e-09 -3.08149016721629e-09 9.188233781823465e-09 ] [ -7.800143045230341e-09 -7.082063825989313e-09 1.236931701018297e-08 ] [ -3.036002770775157e-09 -9.784609582118918e-10 -7.127042691571004e-09 ] [ -2.301055675852685e-10 -5.402478041755361e-09 3.211616228657411e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.204102 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.038142297265852e-18 } }