{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.372830000000001e-10 0.0 0.0 ] "source-value" [ 5.37283 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.56601e-11 5.36059e-10 0.0 ] "source-value" [ -0.256601 5.36059 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.33697e-12 -2.46629e-11 5.473760000000001e-10 ] "source-value" [ 0.0433697 -0.246629 5.47376 ] } "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" [ [ 2.168781896651382e-09 3.285865739577483e-09 -4.779598074492663e-09 ] [ 4.597658902876166e-10 6.848234799937305e-10 6.337944750565747e-10 ] [ 5.481770403589401e-10 2.049222991112748e-09 -1.913280547885137e-09 ] [ -1.03291557698198e-09 -1.684961247014398e-09 1.593587191718229e-09 ] [ 1.54816788778348e-09 8.751961889067936e-10 8.69977579217524e-10 ] [ -3.77881366898784e-10 -3.007125780232506e-09 -3.316793996847744e-10 ] [ -1.220741626156282e-09 1.315124889581637e-09 7.331672369144256e-10 ] [ -2.093354145044373e-09 -3.518146261925487e-09 3.19403153915582e-09 ] ] "source-value" [ [ 1.3536472 2.0508761 -2.9831905 ] [ 0.2869633 0.4274332 0.3955834 ] [ 0.3421452 1.2790244 -1.1941758 ] [ -0.6446952 -1.0516701 0.9946389 ] [ 0.9662904 0.5462545 0.5429973 ] [ -0.235855 -1.8769003 -0.207018 ] [ -0.761927 0.8208364 0.457607 ] [ -1.3065689 -2.1958542 1.9935577 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.70324e-13 -2.80673e-13 1.44383e-11 ] [ 1.34461e-10 1.35881e-10 1.37149e-10 ] [ -2.21547e-12 2.59799e-10 2.84643e-10 ] [ 1.34697e-10 4.04373e-10 4.10747e-10 ] [ 2.75027e-10 9.09757e-13 2.6523e-10 ] [ 4.11164e-10 1.31842e-10 4.20835e-10 ] [ 2.66226e-10 2.78619e-10 -1.7694e-12 ] [ 3.99298e-10 4.09333e-10 1.38778e-10 ] ] "source-value" [ [ 0.00270324 -0.00280673 0.144383 ] [ 1.34461 1.35881 1.37149 ] [ -0.0221547 2.59799 2.84643 ] [ 1.34697 4.04373 4.10747 ] [ 2.75027 0.00909757 2.6523 ] [ 4.11164 1.31842 4.20835 ] [ 2.66226 2.78619 -0.017694 ] [ 3.99298 4.09333 1.38778 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.766957681874139e-18 "source-value" -35.994519 } }