{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-42_1m" } "basis-atom-coordinates" { "source-value" [ [ 0.659119 0.840881 0.50451 ] [ 0.340881 0.159119 0.50451 ] [ 0.840881 0.340881 0.49549 ] [ 0.159119 0.659119 0.49549 ] [ 0.135126 0.364874 0.95348 ] [ 0.364874 0.864874 0.04652 ] [ 0.864874 0.635126 0.95348 ] [ 0.635126 0.135126 0.04652 ] [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0.858502 0.641498 0.280157 ] [ 0.419759 0.671858 0.211972 ] [ 0.328142 0.419759 0.788028 ] [ 0.358502 0.858502 0.719843 ] [ 0.919759 0.828142 0.788028 ] [ 0.580241 0.328142 0.211972 ] [ 0 0.5 0.817911 ] [ 0.141498 0.358502 0.280157 ] [ 0.5 0 0.182089 ] [ 0.641498 0.141498 0.719843 ] [ 0.171858 0.919759 0.211972 ] [ 0.080241 0.171858 0.788028 ] [ 0.828142 0.080241 0.211972 ] [ 0.671858 0.580241 0.788028 ] ] } "species" { "source-value" [ "Gd" "Gd" "Gd" "Gd" "Be" "Be" "Be" "Be" "Ge" "Ge" "O" "O" "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" 7.51713742251 "source-unit" "angstrom" } "c" { "source-value" 4.86829352015 "source-unit" "angstrom" } }