{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmnb" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.635891 0.367918 ] [ 0.75 0.364109 0.632082 ] [ 0.25 0.135891 0.132082 ] [ 0.75 0.864109 0.867918 ] [ 0.75 0.008788 0.38707 ] [ 0.75 0.508788 0.11293 ] [ 0.25 0.991212 0.61293 ] [ 0.25 0.491212 0.88707 ] [ 0.25 0.665392 0.670826 ] [ 0.75 0.334608 0.329174 ] [ 0.25 0.165392 0.829174 ] [ 0.75 0.834608 0.170826 ] [ 0.25 0.732422 0.077392 ] [ 0.75 0.767578 0.577392 ] [ 0.25 0.232422 0.422608 ] [ 0.75 0.267578 0.922608 ] ] } "species" { "source-value" [ "Nb" "Nb" "Nb" "Nb" "Co" "Co" "Co" "Co" "B" "B" "B" "B" "B" "B" "B" "B" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.16019189 "source-unit" "angstrom" } "b" { "source-value" 5.9719977 "source-unit" "angstrom" } "c" { "source-value" 8.20405346 "source-unit" "angstrom" } }