{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmmm" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0.250169 ] [ 0 0 0.749831 ] [ 0 0.5 0.272468 ] [ 0 0.5 0.727532 ] [ 0.5 0.255031 0.5 ] [ 0.5 0.744969 0.5 ] [ 0.5 0.260924 0 ] [ 0.5 0.739076 0 ] [ 0.5 0.305685 0.23006 ] [ 0.5 0.305685 0.76994 ] [ 0.5 0.694315 0.76994 ] [ 0.5 0.694315 0.23006 ] [ 0 0.719268 0.5 ] [ 0 0.280732 0.5 ] [ 0 0.683814 0 ] [ 0 0.316186 0 ] [ 0.5 0 0 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0.5 ] ] } "species" { "source-value" [ "Ba" "Ba" "Ho" "Ho" "Co" "Co" "Co" "Co" "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" 3.915667905 "source-unit" "angstrom" } "b" { "source-value" 7.67838998 "source-unit" "angstrom" } "c" { "source-value" 7.82637186 "source-unit" "angstrom" } }