{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.47225e-10 0.0 0.0 ] "source-value" [ 5.47225 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -7.20088e-12 5.55574e-10 0.0 ] "source-value" [ -0.0720088 5.55574 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.10026e-12 -2.68755e-12 5.37267e-10 ] "source-value" [ -0.0610026 -0.0268755 5.37267 ] } "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" [ [ 2.38687033849234e-09 2.741113672180827e-09 -5.653090508780897e-09 ] [ 4.849769244824489e-09 -2.899417694504943e-09 -2.283756654442583e-09 ] [ -2.574741408829686e-09 -8.330549383382016e-10 6.516428187428839e-09 ] [ -2.084726584159027e-10 3.734245120838736e-09 -1.239071488004206e-09 ] [ -2.049940670108269e-08 -2.382558881205767e-08 -2.240611544090462e-08 ] [ 2.172690166191331e-08 2.306437339056654e-08 2.158346952363644e-08 ] [ 2.728156228977769e-09 -2.574908515851235e-09 2.463955381595904e-11 ] [ -8.409076705879624e-09 5.93237937383616e-10 3.4574971476864e-09 ] ] "source-value" [ [ 1.4897673000000002 1.7108686000000004 -3.528381600000001 ] [ 3.026987900000001 -1.8096742000000003 -1.4254088000000003 ] [ -1.6070272000000005 -0.5199520000000001 4.067234600000001 ] [ -0.13011840000000002 2.3307325000000003 -0.7733676000000003 ] [ -12.794723400000004 -14.870763000000004 -13.984797400000003 ] [ 13.560865500000004 14.395649700000003 13.471342200000004 ] [ 1.7027812000000004 -1.6071315000000004 0.015378800000000003 ] [ -5.248532900000001 0.37027000000000004 2.1580000000000004 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.05094e-12 -7.580470000000001e-12 1.42316e-11 ] [ 1.30951e-10 1.38319e-10 1.48801e-10 ] [ -6.02099e-12 2.69484e-10 2.70363e-10 ] [ 1.30902e-10 4.05591e-10 4.11478e-10 ] [ 2.76224e-10 8.53385e-12 2.86654e-10 ] [ 4.01949e-10 1.17816e-10 4.04456e-10 ] [ 2.72232e-10 2.71295e-10 6.983420000000001e-12 ] [ 4.15368e-10 4.127030000000001e-10 1.42088e-10 ] ] "source-value" [ [ 0.0205094 -0.0758047 0.142316 ] [ 1.30951 1.38319 1.48801 ] [ -0.0602099 2.69484 2.70363 ] [ 1.30902 4.05591 4.11478 ] [ 2.76224 0.0853385 2.86654 ] [ 4.01949 1.17816 4.04456 ] [ 2.72232 2.71295 0.0698342 ] [ 4.15368 4.12703 1.42088 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.381778560685274e-18 "source-value" -33.59042 } }