{ "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" [ [ 0.842957 0.261179 0.852895 ] [ 0.65308 0.389708 0.548832 ] [ 0.861746 0.439959 0.262525 ] [ 0.138254 0.560041 0.737475 ] [ 0.34692 0.610292 0.451168 ] [ 0.157043 0.738821 0.147105 ] [ 0.595941 0.012584 0.159451 ] [ 0.404059 0.987416 0.840549 ] [ 0.135537 0.197403 0.388454 ] [ 0.666055 0.656125 0.930269 ] [ 0.333945 0.343875 0.069731 ] [ 0.864463 0.802597 0.611546 ] [ 0.71957 0.976324 0.716236 ] [ 0.187069 0.223088 0.914765 ] [ 0.868899 0.193068 0.33979 ] [ 0.262794 0.358787 0.517606 ] [ 0.761786 0.492691 0.799946 ] [ 0.588937 0.261197 0.071468 ] [ 0.411063 0.738803 0.928532 ] [ 0.238214 0.507309 0.200054 ] [ 0.737206 0.641213 0.482394 ] [ 0.131101 0.806932 0.66021 ] [ 0.812931 0.776912 0.085235 ] [ 0.28043 0.023676 0.283764 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Ti" "Ti" "B" "B" "B" "B" "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" 5.0227883 "source-unit" "angstrom" } "b" { "source-value" 7.08746048 "source-unit" "angstrom" } "c" { "source-value" 7.97560881 "source-unit" "angstrom" } "alpha" { "source-value" 112.27034897 "source-unit" "degree" } "beta" { "source-value" 89.39747185 "source-unit" "degree" } "gamma" { "source-value" 93.08908337 "source-unit" "degree" } }