{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pnam" } "basis-atom-coordinates" { "source-value" [ [ 0.989218 0.044556 0.25 ] [ 0.510782 0.544556 0.25 ] [ 0.489218 0.455444 0.75 ] [ 0.010782 0.955444 0.75 ] [ 0.5 0 0.5 ] [ 0 0.5 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0 ] [ 0.281956 0.716488 0.541468 ] [ 0.218044 0.216488 0.958532 ] [ 0.781956 0.783512 0.458532 ] [ 0.718044 0.283512 0.041468 ] [ 0.718044 0.283512 0.458532 ] [ 0.781956 0.783512 0.041468 ] [ 0.218044 0.216488 0.541468 ] [ 0.281956 0.716488 0.958532 ] [ 0.922371 0.511562 0.75 ] [ 0.577629 0.011562 0.75 ] [ 0.077629 0.488438 0.25 ] [ 0.422371 0.988438 0.25 ] ] } "species" { "source-value" [ "Pr" "Pr" "Pr" "Pr" "Co" "Co" "Co" "Co" "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" 5.48582722 "source-unit" "angstrom" } "b" { "source-value" 5.53424812 "source-unit" "angstrom" } "c" { "source-value" 7.71442168 "source-unit" "angstrom" } }