{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pnma" } "basis-atom-coordinates" { "source-value" [ [ 0.981674 0.046691 0.25 ] [ 0.481674 0.453309 0.75 ] [ 0.518326 0.546691 0.25 ] [ 0.018326 0.953309 0.75 ] [ 0.5 0 0 ] [ 0.5 0 0.5 ] [ 0 0.5 0 ] [ 0 0.5 0.5 ] [ 0.631397 0.056553 0.75 ] [ 0.196701 0.197895 0.57153 ] [ 0.196701 0.197895 0.92847 ] [ 0.696701 0.302105 0.42847 ] [ 0.696701 0.302105 0.07153 ] [ 0.131397 0.443447 0.25 ] [ 0.868603 0.556553 0.75 ] [ 0.303299 0.697895 0.92847 ] [ 0.303299 0.697895 0.57153 ] [ 0.803299 0.802105 0.07153 ] [ 0.803299 0.802105 0.42847 ] [ 0.368603 0.943447 0.25 ] ] } "species" { "source-value" [ "La" "La" "La" "La" "Ho" "Ho" "Ho" "Ho" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.88351861 "source-unit" "angstrom" } "b" { "source-value" 6.07552416 "source-unit" "angstrom" } "c" { "source-value" 8.57596929 "source-unit" "angstrom" } }