{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.988536 0.25 0.648124 ] [ 0.011464 0.75 0.351876 ] [ 0.381836 0.408293 0.043562 ] [ 0.715059 0.531106 0.596384 ] [ 0.277156 0.75 0.900046 ] [ 0.381836 0.091707 0.043562 ] [ 0.284941 0.468894 0.403616 ] [ 0.722844 0.25 0.099954 ] [ 0.618164 0.591707 0.956438 ] [ 0.715059 0.968894 0.596384 ] [ 0.618164 0.908293 0.956438 ] [ 0.284941 0.031106 0.403616 ] ] } "species" { "source-value" [ "Gd" "Gd" "P" "P" "P" "P" "P" "P" "P" "P" "P" "P" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.93033728 "source-unit" "angstrom" } "b" { "source-value" 9.51641931 "source-unit" "angstrom" } "c" { "source-value" 5.40232437 "source-unit" "angstrom" } "beta" { "source-value" 102.51052463 "source-unit" "degree" } }