{ "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" [ 5.31945 0 0 ] "si-unit" "m" "si-value" [ 5.31945e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00383334 5.41695 0 ] "si-unit" "m" "si-value" [ -3.83334e-13 5.416950000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0189848 -0.118491 5.47074 ] "si-unit" "m" "si-value" [ 1.89848e-12 -1.18491e-11 5.47074e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0147515 -0.0960157 0.0381768 ] [ 1.54242 1.27348 1.38773 ] [ -0.0738039 2.51333 2.6891 ] [ 1.45374 4.04036 4.07661 ] [ 2.81495 -0.0309523 2.80877 ] [ 4.27456 1.30079 3.98727 ] [ 2.73206 2.74248 -0.103972 ] [ 3.9224 4.04214 1.39211 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.47515e-12 -9.60157e-12 3.81768e-12 ] [ 1.54242e-10 1.27348e-10 1.38773e-10 ] [ -7.38039e-12 2.51333e-10 2.6891e-10 ] [ 1.45374e-10 4.04036e-10 4.07661e-10 ] [ 2.81495e-10 -3.09523e-12 2.80877e-10 ] [ 4.27456e-10 1.30079e-10 3.98727e-10 ] [ 2.73206e-10 2.74248e-10 -1.03972e-11 ] [ 3.9224e-10 4.04214e-10 1.39211e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.4994976 3.0458109 -0.2975345 ] [ -3.1601643 0.748864 -1.1298154 ] [ 14.7501032 16.2602524 -14.752701 ] [ -3.3435985 -2.6025215 -1.402029 ] [ -0.2666512 1.9735807 0.6718523 ] [ -14.6452835 -13.5004052 17.0932276 ] [ 1.4455171 -2.8447052 -0.3709512 ] [ 2.7205797 -3.0808761 0.1879512 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.00463661846571e-09 4.879927015357807e-09 -4.767028197814176e-10 ] [ -5.063141359346798e-09 1.199812392958771e-09 -1.8101638196998e-09 ] [ 2.363227050142727e-08 2.605179624358709e-08 -2.363643263585278e-08 ] [ -5.357035346041949e-09 -4.169699102429347e-09 -2.246298085483603e-09 ] [ -4.272223185482649e-10 3.162024856802099e-09 1.076426047690708e-09 ] [ -2.3464330828688e-08 -2.163003358276675e-08 2.738636963473329e-08 ] [ 2.315973702586615e-09 -4.557720164508188e-09 -5.943293400977049e-10 ] [ 4.358849190363077e-09 -4.936107659001483e-09 3.01131018491305e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -32.540963 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.213637013691783e-18 } }