{ "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" [ 5.44976 0 0 ] "si-unit" "m" "si-value" [ 5.449760000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0355309 5.38277 0 ] "si-unit" "m" "si-value" [ -3.55309e-12 5.38277e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.05055 0.148675 5.46244 ] "si-unit" "m" "si-value" [ 5.055e-12 1.48675e-11 5.46244e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0326933 -0.0289977 0.141129 ] [ 1.38935 1.3881 1.19735 ] [ 0.0127821 2.83796 2.59214 ] [ 1.40644 4.238 3.96398 ] [ 2.76811 0.0511022 2.83036 ] [ 4.1335 1.52222 4.23862 ] [ 2.69114 2.71897 0.000278438 ] [ 4.17588 4.12802 1.32379 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.26933e-12 -2.89977e-12 1.41129e-11 ] [ 1.38935e-10 1.3881e-10 1.19735e-10 ] [ 1.27821e-12 2.83796e-10 2.59214e-10 ] [ 1.40644e-10 4.238000000000001e-10 3.96398e-10 ] [ 2.76811e-10 5.11022e-12 2.830360000000001e-10 ] [ 4.1335e-10 1.52222e-10 4.23862e-10 ] [ 2.69114e-10 2.71897e-10 2.78438e-14 ] [ 4.17588e-10 4.12802e-10 1.32379e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3469156 1.1015317 -3.9167237 ] [ -1.1210744 0.9025608 2.1615043 ] [ 1.2522088 -1.6908152 1.8996379 ] [ -2.5941887 -2.1989373 2.6734099 ] [ 3.5040209 1.7236822 -1.65897 ] [ 0.5073058 -0.5751227 -1.750039 ] [ 1.0154365 1.6420111 -0.688776 ] [ -3.9106244 -0.9049106 1.2799565 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.15799670229009e-09 1.764848351350298e-09 -6.275283193974025e-09 ] [ -1.796159208655569e-09 1.446061824524347e-09 3.463111683750525e-09 ] [ 2.006259680249179e-09 -2.708984605852037e-09 3.043555456440829e-09 ] [ -4.156348519326836e-09 -3.523085961691048e-09 4.283274874884276e-09 ] [ 5.614060411027649e-09 2.761643345281715e-09 -2.65796297050698e-09 ] [ 8.127934990526772e-10 -9.214481516229916e-10 -2.803871594388725e-09 ] [ 1.626908633610741e-09 2.630791817188637e-09 -1.103540813259984e-09 ] [ -6.265511038030269e-09 -1.44982661917892e-09 2.050716396836421e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -33.608626 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.384695527804488e-18 } }