{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4/nmm" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.75 0 ] [ 0.75 0.75 0 ] [ 0.75 0.25 0 ] [ 0.25 0.25 0 ] [ 0.5 0 0.613201 ] [ 0 0.5 0.386799 ] [ 0 0 0.5 ] [ 0.5 0.5 0.5 ] [ 0 0.772972 0.26375 ] [ 0.5 0 0.250331 ] [ 0.772972 0 0.73625 ] [ 0.227028 0 0.73625 ] [ 0 0.227028 0.26375 ] [ 0.5 0.272972 0.73625 ] [ 0.272972 0.5 0.26375 ] [ 0.727028 0.5 0.26375 ] [ 0 0.5 0.749669 ] [ 0.5 0.727028 0.73625 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "V" "V" "Co" "Co" "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" 6.60969243 "source-unit" "angstrom" } "c" { "source-value" 4.60459597 "source-unit" "angstrom" } }