{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "I4/m" } "basis-atom-coordinates" { "source-value" [ [ 0 0.5 0.25 ] [ 0.5 0 0.25 ] [ 0.5 0 0.75 ] [ 0 0.5 0.75 ] [ 0 0 0 ] [ 0.5 0.5 0.5 ] [ 0.5 0.5 0 ] [ 0 0 0.5 ] [ 0.696752 0.788498 0 ] [ 0.211502 0.696752 0 ] [ 0.788498 0.303248 0 ] [ 0.303248 0.211502 0 ] [ 0.5 0.5 0.763735 ] [ 0.5 0.5 0.236265 ] [ 0.196752 0.288498 0.5 ] [ 0.711502 0.196752 0.5 ] [ 0.288498 0.803248 0.5 ] [ 0.803248 0.711502 0.5 ] [ 0 0 0.263735 ] [ 0 0 0.736265 ] ] } "species" { "source-value" [ "Sr" "Sr" "Sr" "Sr" "Co" "Co" "W" "W" "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" 5.59103870062 "source-unit" "angstrom" } "c" { "source-value" 8.27273277168 "source-unit" "angstrom" } }