{ "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" [ 5.42356 0 0 ] "si-unit" "m" "si-value" [ 5.42356e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0141122 5.36968 0 ] "si-unit" "m" "si-value" [ 1.41122e-12 5.36968e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.125956 0.0899535 5.38067 ] "si-unit" "m" "si-value" [ -1.25956e-11 8.99535e-12 5.380670000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0132742 0.0797855 -0.0480858 ] [ 1.38077 1.28242 1.3281 ] [ 0.0139699 2.87381 2.72647 ] [ 1.34708 4.2887 4.09361 ] [ 2.73598 0.0766444 2.67003 ] [ 4.1072 1.37855 3.98819 ] [ 2.71459 2.70679 -0.0921964 ] [ 4.08895 4.12737 1.11939 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.32742e-12 7.97855e-12 -4.80858e-12 ] [ 1.38077e-10 1.28242e-10 1.3281e-10 ] [ 1.39699e-12 2.873810000000001e-10 2.72647e-10 ] [ 1.34708e-10 4.2887e-10 4.09361e-10 ] [ 2.73598e-10 7.66444e-12 2.67003e-10 ] [ 4.1072e-10 1.37855e-10 3.98819e-10 ] [ 2.71459e-10 2.70679e-10 -9.21964e-12 ] [ 4.08895e-10 4.12737e-10 1.11939e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6681063 -0.5118424 0.5439687 ] [ -0.407661 2.0192105 0.0162322 ] [ 0.220917 -0.5874848 -0.8617342 ] [ -0.3538859 -0.8522461 -0.9120571 ] [ 0.5279461 -0.5588056 -0.3139334 ] [ -1.4100769 2.1126007 -0.8807796 ] [ 0.4870546 -0.7833297 0.3759816 ] [ -0.7324003 -0.8381028 2.0323218 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.672600936888194e-09 -8.200619335704816e-10 8.715339407673557e-10 ] [ -6.531449287930738e-10 3.235131882227456e-09 2.600685155841479e-11 ] [ 3.539480554533779e-10 -9.412544193901632e-10 -1.380650399958683e-09 ] [ -5.669877200820605e-10 -1.365448787837627e-09 -1.461276574493801e-09 ] [ 8.458629054314272e-10 -8.953052752683503e-10 -5.029767581121755e-10 ] [ -2.259192261323154e-09 3.384759478512044e-09 -1.411164494823866e-09 ] [ 7.803474996022163e-10 -1.25503254205823e-09 6.023889343339344e-10 ] [ -1.17343464739459e-09 -1.342788723049975e-09 3.256138500728821e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.222235 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.803441854825699e-18 } }