{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1nb" } "basis-atom-coordinates" { "source-value" [ [ 0.330738 0.500087 0.921426 ] [ 0.169262 0.500087 0.421426 ] [ 0.830738 0.000087 0.578574 ] [ 0.669262 0.000087 0.078574 ] [ 0.670185 0.24807 0.330486 ] [ 0.829815 0.24807 0.830486 ] [ 0.329815 0.74807 0.669514 ] [ 0.170185 0.74807 0.169514 ] [ 0.331839 0.2509 0.66744 ] [ 0.168161 0.2509 0.16744 ] [ 0.668161 0.7509 0.33256 ] [ 0.831839 0.7509 0.83256 ] [ 0.281943 0.024592 0.103903 ] [ 0.218057 0.024592 0.603903 ] [ 0.84505 0.23098 0.181305 ] [ 0.300926 0.271243 0.301707 ] [ 0.199074 0.271243 0.801707 ] [ 0.65495 0.23098 0.681305 ] [ 0.237477 0.47395 0.089466 ] [ 0.262523 0.47395 0.589466 ] [ 0.718057 0.524592 0.896097 ] [ 0.781943 0.524592 0.396097 ] [ 0.800926 0.771243 0.198293 ] [ 0.34505 0.73098 0.318695 ] [ 0.699074 0.771243 0.698293 ] [ 0.15495 0.73098 0.818695 ] [ 0.737477 0.97395 0.410534 ] [ 0.762523 0.97395 0.910534 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Fe" "Fe" "Fe" "Fe" "Si" "Si" "Si" "Si" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.06284131 "source-unit" "angstrom" } "b" { "source-value" 6.09566323 "source-unit" "angstrom" } "c" { "source-value" 11.23924565 "source-unit" "angstrom" } }