{ "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" [ 5.46308 0 0 ] "si-unit" "m" "si-value" [ 5.46308e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0404011 5.38219 0 ] "si-unit" "m" "si-value" [ -4.04011e-12 5.38219e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0107061 -0.144189 5.56456 ] "si-unit" "m" "si-value" [ 1.07061e-12 -1.44189e-11 5.56456e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0957934 0.00987827 -0.0909378 ] [ 1.38627 1.24986 1.3117 ] [ -0.0751597 2.80438 2.76133 ] [ 1.36904 3.93592 4.18176 ] [ 2.71956 -0.067532 2.7564 ] [ 4.08015 1.26891 4.08099 ] [ 2.56948 2.74723 0.13466 ] [ 4.07358 4.09238 1.48906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.579340000000001e-12 9.87827e-13 -9.09378e-12 ] [ 1.38627e-10 1.24986e-10 1.3117e-10 ] [ -7.51597e-12 2.80438e-10 2.76133e-10 ] [ 1.36904e-10 3.93592e-10 4.18176e-10 ] [ 2.71956e-10 -6.7532e-12 2.7564e-10 ] [ 4.08015e-10 1.26891e-10 4.08099e-10 ] [ 2.56948e-10 2.74723e-10 1.3466e-11 ] [ 4.07358e-10 4.092380000000001e-10 1.48906e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2710964 -0.0218487 0.2684859 ] [ -1.5923028 -0.1646578 1.1208704 ] [ 1.112277 -2.2290234 0.3046655 ] [ -0.0647715 0.4192422 0.1963093 ] [ -0.9866835 0.5700754 0.6670829 ] [ -0.3060473 1.1241118 0.8120541 ] [ 1.8989196 0.3629207 -1.2011087 ] [ -0.3324878 -0.0608202 -2.1683594 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.343443176415175e-10 -3.500547662327579e-11 4.301618355384606e-10 ] [ -2.551150340412775e-09 -2.638108797658452e-10 1.795832364622234e-09 ] [ 1.782064219935618e-09 -3.571289208119235e-09 4.88127945285927e-10 ] [ -1.03775383849131e-10 6.717000568267547e-10 3.145221734968962e-10 ] [ -1.580841248853339e-09 9.133614854982035e-10 1.068784635320958e-09 ] [ -4.903418329587882e-10 1.801025659963681e-09 1.301054104563899e-09 ] [ 3.042404612964626e-09 5.814630655349237e-10 -1.924388294034115e-09 ] [ -5.327041842500651e-10 -9.744470331520678e-11 -3.474094764794259e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.310932 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.817652680916289e-18 } }