{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0.023975 0.991785 0.249071 ] [ 0.476025 0.491785 0.750929 ] [ 0.523975 0.508215 0.249071 ] [ 0.976025 0.008215 0.750929 ] [ 0 0.5 0.5 ] [ 0 0.5 0 ] [ 0.5 0 0.5 ] [ 0.5 0 0 ] [ 0.040324 0.389244 0.748411 ] [ 0.17636 0.175805 0.039135 ] [ 0.186907 0.812739 0.564519 ] [ 0.313093 0.312739 0.435481 ] [ 0.32364 0.675805 0.960865 ] [ 0.459676 0.889244 0.251589 ] [ 0.540324 0.110756 0.748411 ] [ 0.67636 0.324195 0.039135 ] [ 0.686907 0.687261 0.564519 ] [ 0.813093 0.187261 0.435481 ] [ 0.82364 0.824195 0.960865 ] [ 0.959676 0.610756 0.251589 ] ] } "species" { "source-value" [ "La" "La" "La" "La" "Ho" "Ho" "Ho" "Ho" "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" 6.03314567 "source-unit" "angstrom" } "b" { "source-value" 6.08585414 "source-unit" "angstrom" } "c" { "source-value" 8.51063131 "source-unit" "angstrom" } "beta" { "source-value" 90.1430027 "source-unit" "degree" } }