{ "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" [ [ 0.5 0 0.5 ] [ 0.045023 0.875324 0.833031 ] [ 0.954977 0.124676 0.166969 ] [ 0.716028 0.551668 0.833959 ] [ 0.826054 0.347806 0.50072 ] [ 0.173946 0.652194 0.49928 ] [ 0.391809 0.224978 0.833748 ] [ 0.283972 0.448332 0.166041 ] [ 0.608191 0.775022 0.166252 ] [ 0.136227 0.228008 0.662833 ] [ 0.863773 0.771992 0.337167 ] [ 0.231251 0.057779 0.329489 ] [ 0.419157 0.651068 0.668556 ] [ 0.580843 0.348932 0.331444 ] [ 0.282814 0.853512 0.006241 ] [ 0.768749 0.942221 0.670511 ] [ 0.717186 0.146488 0.993759 ] [ 0 0.5 0 ] ] } "species" { "source-value" [ "Tb" "Tb" "Tb" "Na" "Na" "Na" "Na" "Na" "Na" "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" 5.85204135 "source-unit" "angstrom" } "b" { "source-value" 5.91818876 "source-unit" "angstrom" } "c" { "source-value" 8.89292053 "source-unit" "angstrom" } "alpha" { "source-value" 70.91194575 "source-unit" "degree" } "beta" { "source-value" 72.3877363 "source-unit" "degree" } "gamma" { "source-value" 61.21145279 "source-unit" "degree" } }