{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Fmm2" } "basis-atom-coordinates" { "source-value" [ [ 0 0.000441 0 ] [ 0 0.500441 0.5 ] [ 0.5 0.500441 0 ] [ 0.5 0.000441 0.5 ] [ 0 0.66652 0 ] [ 0 0.16652 0.5 ] [ 0.5 0.16652 0 ] [ 0.5 0.66652 0.5 ] ] } "species" { "source-value" [ "B" "B" "B" "B" "N" "N" "N" "N" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 2.51533983 "source-unit" "angstrom" } "b" { "source-value" 4.33983126 "source-unit" "angstrom" } "c" { "source-value" 6.04508014 "source-unit" "angstrom" } }