{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmnb" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.525748 0.819867 ] [ 0.75 0.474252 0.180133 ] [ 0.25 0.025748 0.680133 ] [ 0.75 0.974252 0.319867 ] [ 0.75 0.367558 0.553601 ] [ 0.25 0.132442 0.053601 ] [ 0.75 0.867558 0.946399 ] [ 0.25 0.632442 0.446399 ] [ 0.25 0.274203 0.378515 ] [ 0.75 0.225797 0.878515 ] [ 0.25 0.774203 0.121485 ] [ 0.75 0.725797 0.621485 ] ] } "species" { "source-value" [ "Er" "Er" "Er" "Er" "Mn" "Mn" "Mn" "Mn" "Ge" "Ge" "Ge" "Ge" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.06901678 "source-unit" "angstrom" } "b" { "source-value" 7.00165234 "source-unit" "angstrom" } "c" { "source-value" 7.91513128 "source-unit" "angstrom" } }