{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2/m" } "basis-atom-coordinates" { "source-value" [ [ 0.834011 0 0.169924 ] [ 0.665989 0.5 0.830076 ] [ 0.334011 0.5 0.169924 ] [ 0.165989 0 0.830076 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.847157 0.5 0.393022 ] [ 0.009786 0 0.714253 ] [ 0.676851 0 0.05534 ] [ 0.990214 0 0.285747 ] [ 0.652843 0 0.606978 ] [ 0.823149 0.5 0.94466 ] [ 0.347157 0 0.393022 ] [ 0.509786 0.5 0.714253 ] [ 0.176851 0.5 0.05534 ] [ 0.490214 0.5 0.285747 ] [ 0.152843 0.5 0.606978 ] [ 0.323149 0 0.94466 ] ] } "species" { "source-value" [ "Mn" "Mn" "Mn" "Mn" "Co" "Co" "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" 12.72111384 "source-unit" "angstrom" } "b" { "source-value" 2.89797927 "source-unit" "angstrom" } "c" { "source-value" 5.85914692 "source-unit" "angstrom" } "beta" { "source-value" 104.25637832 "source-unit" "degree" } }