{ "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 0 0.169507 ] [ 0 0 0.830493 ] [ 0.5 0.5 0.330493 ] [ 0.5 0.5 0.669507 ] [ 0 0 0.5 ] [ 0.5 0.5 0 ] [ 0.203755 0.796245 0.325217 ] [ 0.189863 0.810137 0 ] [ 0.203755 0.796245 0.674783 ] [ 0.296245 0.296245 0.174783 ] [ 0.310137 0.310137 0.5 ] [ 0.296245 0.296245 0.825217 ] [ 0.703755 0.703755 0.174783 ] [ 0.689863 0.689863 0.5 ] [ 0.703755 0.703755 0.825217 ] [ 0.810137 0.189863 0 ] [ 0.796245 0.203755 0.325217 ] [ 0.796245 0.203755 0.674783 ] ] } "species" { "source-value" [ "Nb" "Nb" "Nb" "Nb" "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" 4.83296648 "source-unit" "angstrom" } "c" { "source-value" 9.20530117 "source-unit" "angstrom" } }