{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-hexagonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-62m" } "basis-atom-coordinates" { "source-value" [ [ 0.272415 0.455888 0 ] [ 0.183473 0.727585 0 ] [ 0.544112 0.816527 0 ] [ 0.816527 0.544112 0 ] [ 0.727585 0.183473 0 ] [ 0.455888 0.272415 0 ] [ 0.434311 0 0.5 ] [ 0.565689 0.565689 0.5 ] [ 0 0.434311 0.5 ] [ 0.794008 0 0.5 ] [ 0.205992 0.205992 0.5 ] [ 0 0.794008 0.5 ] [ 0.161061 0 0 ] [ 0.838939 0.838939 0 ] [ 0 0.161061 0 ] [ 0.333333 0.666667 0.5 ] [ 0.666667 0.333333 0.5 ] [ 0.282819 0.468367 0.5 ] [ 0.185548 0.717181 0.5 ] [ 0.531633 0.814452 0.5 ] [ 0.814452 0.531633 0.5 ] [ 0.717181 0.185548 0.5 ] [ 0.468367 0.282819 0.5 ] [ 0.335687 0 0 ] [ 0.664313 0.664313 0 ] [ 0 0.335687 0 ] [ 0.460054 0 0 ] [ 0.539946 0.539946 0 ] [ 0 0.460054 0 ] [ 0.792775 0 0 ] [ 0.207225 0.207225 0 ] [ 0 0.792775 0 ] ] } "species" { "source-value" [ "Tb" "Tb" "Tb" "Tb" "Tb" "Tb" "Tb" "Tb" "Tb" "Tb" "Tb" "Tb" "Os" "Os" "Os" "Os" "Os" "C" "C" "C" "C" "C" "C" "C" "C" "C" "C" "C" "C" "C" "C" "C" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 10.7503250251 "source-unit" "angstrom" } "c" { "source-value" 5.11590576 "source-unit" "angstrom" } }