{ "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" [ 5.4238 0 0 ] "si-unit" "m" "si-value" [ 5.4238e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0012341 5.50722 0 ] "si-unit" "m" "si-value" [ -1.2341e-13 5.507220000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00966142 -0.113973 5.43239 ] "si-unit" "m" "si-value" [ -9.661420000000001e-13 -1.13973e-11 5.43239e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0339885 -0.0385369 0.0299316 ] [ 1.35039 1.32575 1.36375 ] [ -0.105411 2.62445 2.64243 ] [ 1.34087 3.97443 4.1654 ] [ 2.65221 0.0889868 2.75972 ] [ 4.05512 1.26127 4.10909 ] [ 2.71709 2.70534 0.0564386 ] [ 4.05687 4.02913 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.39885e-12 -3.85369e-12 2.99316e-12 ] [ 1.35039e-10 1.32575e-10 1.36375e-10 ] [ -1.05411e-11 2.62445e-10 2.64243e-10 ] [ 1.34087e-10 3.97443e-10 4.1654e-10 ] [ 2.652210000000001e-10 8.89868e-12 2.75972e-10 ] [ 4.05512e-10 1.26127e-10 4.10909e-10 ] [ 2.71709e-10 2.70534e-10 5.64386e-12 ] [ 4.05687e-10 4.02913e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1401852 -0.2556567 0.0649958 ] [ -0.4793374 0.2924812 -0.275961 ] [ 1.0790688 0.2503498 1.3240483 ] [ -0.1921664 0.3997726 -1.2135841 ] [ 0.1956184 -2.3937321 0.0841448 ] [ 0.1401108 0.4291193 0.0595827 ] [ -0.2265065 -0.030046 -0.3107424 ] [ -0.656973 1.3077119 0.2675159 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.246014500221722e-10 -4.096071876908794e-10 1.041347512101926e-10 ] [ -7.67983175755058e-10 4.686065406635289e-10 -4.421382624525888e-10 ] [ 1.728858803594711e-09 4.011045965819558e-10 2.121359231069985e-09 ] [ -3.078845133833011e-10 6.4050631335643e-10 -1.94437607239461e-09 ] [ 3.134152270783027e-10 -3.835181607078487e-09 1.348148313218919e-10 ] [ 2.244822480815847e-10 6.875249099940614e-10 9.546200894414017e-11 ] [ -3.629034187592352e-10 -4.81389987485568e-11 -4.978642083712819e-10 ] [ -1.052586781096839e-09 2.095185432921947e-09 4.286077206722707e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -22.283845 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.570265548053098e-18 } }