{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pm2m" } "basis-atom-coordinates" { "source-value" [ [ 0 0.001325 0.841054 ] [ 0 0.001325 0.158946 ] [ 0 0.00705 0.5 ] [ 0.5 0.504988 0.331044 ] [ 0.5 0.504988 0.668956 ] [ 0 0.25252 0.328536 ] [ 0.5 0.753443 0.5 ] [ 0 0.25252 0.671464 ] [ 0.5 0.743589 0.836638 ] [ 0 0.23466 0 ] [ 0.5 0.743589 0.163362 ] ] } "species" { "source-value" [ "Ga" "Ga" "Ga" "Ga" "Ga" "P" "P" "P" "S" "S" "S" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.83125014 "source-unit" "angstrom" } "b" { "source-value" 5.50107996 "source-unit" "angstrom" } "c" { "source-value" 11.47678652 "source-unit" "angstrom" } }