{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmcb" } "basis-atom-coordinates" { "source-value" [ [ 0 0.131463 0.648839 ] [ 0 0.868537 0.351161 ] [ 0 0.631463 0.851161 ] [ 0 0.368537 0.148839 ] [ 0.5 0.790767 0.687305 ] [ 0.5 0.209233 0.312695 ] [ 0.5 0.290767 0.812695 ] [ 0.5 0.709233 0.187305 ] [ 0.5 0.864208 0.530569 ] [ 0.5 0.135792 0.469431 ] [ 0.5 0.364208 0.969431 ] [ 0.5 0.635792 0.030569 ] [ 0.5 0.021854 0.192977 ] [ 0.5 0.978146 0.807023 ] [ 0.5 0.521854 0.307023 ] [ 0.5 0.478146 0.692977 ] [ 0.5 0.112824 0.047273 ] [ 0.5 0.887176 0.952727 ] [ 0.5 0.612824 0.452727 ] [ 0.5 0.387176 0.547273 ] [ 0 0.64282 0.594738 ] [ 0 0.35718 0.405262 ] [ 0 0.14282 0.905262 ] [ 0 0.85718 0.094738 ] ] } "species" { "source-value" [ "Er" "Er" "Er" "Er" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "Rh" "Rh" "Rh" "Rh" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.55383808 "source-unit" "angstrom" } "b" { "source-value" 5.94177222 "source-unit" "angstrom" } "c" { "source-value" 11.52929149 "source-unit" "angstrom" } }