{ "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" [ [ 2.4302772 -0.8222752 0.7259001 ] [ -0.5509399 2.8710115 -0.0322482 ] [ 0.1613125 -0.7658127 -1.2236413 ] [ -0.7096582 -1.3897552 -1.3842986 ] [ 0.712273 -0.7416991 -0.5846511 ] [ -2.0921558 3.1206724 -1.2435027 ] [ 0.8644773 -1.096245 0.538989 ] [ -0.8155862 -1.1758966 3.2034529 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.893733311903286e-09 -1.317430101303644e-09 1.163020169256382e-09 ] [ -8.8270302724589e-10 4.599867503347939e-09 -5.166731210288255e-11 ] [ 2.584511161428e-10 -1.226967203851724e-09 -1.960489483105319e-09 ] [ -1.136997776799011e-09 -2.226633290075228e-09 -2.217890853126171e-09 ] [ 1.141187148227079e-09 -1.188332957688401e-09 -9.367143237450027e-10 ] [ -3.352003109831121e-09 4.999868360455826e-09 -1.992310953841676e-09 ] [ 1.385045319272308e-09 -1.756378109668896e-09 8.635555746683714e-10 ] [ -1.306713141887113e-09 -1.883994040998209e-09 5.13249734221396e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.728038 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.884480381145399e-18 } }