{ "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" [ 5.51526 0 0 ] "si-unit" "m" "si-value" [ 5.51526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0933018 5.35906 0 ] "si-unit" "m" "si-value" [ -9.33018e-12 5.35906e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.235006 -0.443739 5.60819 ] "si-unit" "m" "si-value" [ 2.35006e-11 -4.43739e-11 5.60819e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0139599 -0.0171452 -0.258284 ] [ 1.4668 1.50235 1.27166 ] [ -0.150248 2.65293 3.01531 ] [ 1.35939 3.8116 4.44507 ] [ 2.6266 -0.11212 2.88055 ] [ 3.83653 1.13315 3.7283 ] [ 2.72617 2.6833 0.230289 ] [ 3.93014 4.1583 1.51189 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.39599e-12 -1.71452e-12 -2.58284e-11 ] [ 1.4668e-10 1.50235e-10 1.27166e-10 ] [ -1.50248e-11 2.65293e-10 3.01531e-10 ] [ 1.35939e-10 3.8116e-10 4.44507e-10 ] [ 2.6266e-10 -1.1212e-11 2.88055e-10 ] [ 3.83653e-10 1.13315e-10 3.7283e-10 ] [ 2.72617e-10 2.6833e-10 2.30289e-11 ] [ 3.930140000000001e-10 4.1583e-10 1.51189e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -22.8528574 23.497792 18.9891652 ] [ -12.2565481 -12.440777 10.2691471 ] [ 3.7954047 3.8947916 -7.207155 ] [ 23.2156628 -21.3695849 -17.1087483 ] [ -17.9406256 -12.7929464 -13.5241667 ] [ 14.3720283 11.7442628 21.1546856 ] [ 6.99465 9.4658553 -12.4635748 ] [ 4.6722853 -1.9993933 -0.1093531 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.661431414641399e-08 3.764761329299212e-08 3.042399678260593e-08 ] [ -1.96371549793171e-08 -1.993232221820462e-08 1.645298753472886e-08 ] [ 6.080908726913779e-09 6.240144095819473e-09 -1.154713533861627e-08 ] [ 3.719559248098301e-08 -3.423784960505923e-08 -2.741123676324722e-08 ] [ -2.874405113566223e-08 -2.049655980209441e-08 -2.166810388106088e-08 ] [ 2.302652792544674e-08 1.881638344171541e-08 3.389354296793626e-08 ] [ 1.12066647930081e-08 1.516597218248506e-08 -1.996884832067122e-08 ] [ 7.48582633504168e-09 -3.203381227436152e-09 -1.752029816754654e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.726915 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.160600227390411e-18 } }