{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0.485604 0.778964 0.413059 ] [ 0.513072 0.614426 0.774978 ] [ 0 0.5 0.5 ] [ 0.486928 0.385574 0.225022 ] [ 0.514396 0.221036 0.586941 ] [ 0.5 0 0 ] [ 0.00663 0.313185 0.882571 ] [ 0.99337 0.686815 0.117429 ] [ 0.008537 0.900659 0.692289 ] [ 0.991463 0.099341 0.307711 ] [ 0.238301 0.951299 0.857132 ] [ 0.774276 0.674419 0.933766 ] [ 0.779268 0.874009 0.541148 ] [ 0.260589 0.75703 0.231253 ] [ 0.241301 0.543895 0.661091 ] [ 0.758699 0.456105 0.338909 ] [ 0.739411 0.24297 0.768747 ] [ 0.220732 0.125991 0.458852 ] [ 0.225724 0.325581 0.066234 ] [ 0.761699 0.048701 0.142868 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Fe" "Fe" "Fe" "Ni" "Ni" "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" 5.09475192 "source-unit" "angstrom" } "b" { "source-value" 5.16873762 "source-unit" "angstrom" } "c" { "source-value" 7.73716556 "source-unit" "angstrom" } "alpha" { "source-value" 71.05795782 "source-unit" "degree" } "beta" { "source-value" 71.88144117 "source-unit" "degree" } "gamma" { "source-value" 81.49652725 "source-unit" "degree" } }