{ "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" [ 5.23298 0 0 ] "si-unit" "m" "si-value" [ 5.23298e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.924429 5.53043 0 ] "si-unit" "m" "si-value" [ -9.24429e-11 5.53043e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.629107 -0.473789 5.46851 ] "si-unit" "m" "si-value" [ -6.29107e-11 -4.73789e-11 5.46851e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.204863 0.0604192 -0.0594365 ] [ 1.57212 1.62558 1.26329 ] [ -0.456749 2.61396 2.82457 ] [ 0.563094 3.85296 4.15247 ] [ 2.57153 0.0726254 2.31215 ] [ 3.48703 1.34311 4.10214 ] [ 2.49706 2.93083 0.328276 ] [ 3.43659 4.115 1.72734 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04863e-11 6.04192e-12 -5.94365e-12 ] [ 1.57212e-10 1.62558e-10 1.26329e-10 ] [ -4.56749e-11 2.61396e-10 2.82457e-10 ] [ 5.63094e-11 3.85296e-10 4.15247e-10 ] [ 2.57153e-10 7.262540000000001e-12 2.31215e-10 ] [ 3.48703e-10 1.34311e-10 4.102140000000001e-10 ] [ 2.49706e-10 2.93083e-10 3.28276e-11 ] [ 3.43659e-10 4.115e-10 1.72734e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.8001305 1.3685003 -1.1792552 ] [ -14.9978792 -10.4753688 3.5305665 ] [ 2.5890322 -0.8467332 -1.7997337 ] [ 1.0169881 3.7398483 3.2165188 ] [ 2.0516533 -3.1032838 7.2180344 ] [ -0.952747 -2.8401332 2.2580998 ] [ 3.902595 3.8893427 -11.9150584 ] [ 4.590227 8.2678277 -1.3291722 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.884127001489014e-09 2.192579186217786e-09 -1.889375111396828e-09 ] [ -2.402925141582261e-08 -1.678339098561775e-08 5.656591104479683e-09 ] [ 4.14808686133839e-09 -1.356616137095171e-09 -2.883491257805881e-09 ] [ 1.629394557451813e-09 5.991897511598624e-09 5.15343122172367e-09 ] [ 3.287110951247168e-09 -4.972008752067383e-09 1.156456596381016e-08 ] [ -1.526468968937338e-09 -4.550395012997891e-09 3.617874706993156e-09 ] [ 6.252646469450976e-09 6.231413944219148e-09 -1.909002800394665e-08 ] [ 7.354354383564921e-09 1.324652024574263e-08 -2.129568623857302e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.611957 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.943270209753491e-18 } }