{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4_2/n" } "basis-atom-coordinates" { "source-value" [ [ 0.75 0.75 0.25 ] [ 0.25 0.25 0.75 ] [ 0.914294 0.03059 0.861016 ] [ 0.414294 0.53059 0.138984 ] [ 0.53059 0.085706 0.361016 ] [ 0.96941 0.414294 0.361016 ] [ 0.585706 0.46941 0.861016 ] [ 0.085706 0.96941 0.138984 ] [ 0.46941 0.914294 0.638984 ] [ 0.03059 0.585706 0.638984 ] [ 0.603875 0.356616 0.362255 ] [ 0.896125 0.143384 0.362255 ] [ 0.856616 0.396125 0.862255 ] [ 0.356616 0.896125 0.137745 ] [ 0.396125 0.643384 0.637745 ] [ 0.103875 0.856616 0.637745 ] [ 0.143384 0.603875 0.137745 ] [ 0.643384 0.103875 0.862255 ] ] } "species" { "source-value" [ "Nd" "Nd" "B" "B" "B" "B" "B" "B" "B" "B" "Os" "Os" "Os" "Os" "Os" "Os" "Os" "Os" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.62822829 "source-unit" "angstrom" } "c" { "source-value" 4.00770763 "source-unit" "angstrom" } }