{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4_2/mnm" } "basis-atom-coordinates" { "source-value" [ [ 0.673414 0.326586 0 ] [ 0.826586 0.826586 0.5 ] [ 0.173414 0.173414 0.5 ] [ 0.326586 0.673414 0 ] [ 0.311353 0.311353 0 ] [ 0.811353 0.188647 0.5 ] [ 0.188647 0.811353 0.5 ] [ 0.688647 0.688647 0 ] ] } "species" { "source-value" [ "Be" "Be" "Be" "Be" "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" 4.64187573 "source-unit" "angstrom" } "c" { "source-value" 2.70097331 "source-unit" "angstrom" } }