{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4" } "basis-atom-coordinates" { "source-value" [ [ 0.676486 0.835239 0.937966 ] [ 0.164761 0.676486 0.937966 ] [ 0.323514 0.164761 0.937966 ] [ 0.835239 0.323514 0.937966 ] [ 0.617638 0.142663 0.461115 ] [ 0.142663 0.382362 0.461115 ] [ 0.382362 0.857337 0.461115 ] [ 0.5 0.5 0.488793 ] [ 0.857337 0.617638 0.461115 ] [ 0 0 0.489575 ] [ 0 0 0.043858 ] [ 0.143028 0.385281 0.172687 ] [ 0 0.5 0.572033 ] [ 0.787351 0.112291 0.562351 ] [ 0.112291 0.212649 0.562351 ] [ 0.614719 0.143028 0.172687 ] [ 0.5 0.5 0.208196 ] [ 0.212649 0.887709 0.562351 ] [ 0.445755 0.689826 0.575635 ] [ 0.689826 0.554245 0.575635 ] [ 0.310174 0.445755 0.575635 ] [ 0.5 0 0.572033 ] [ 0.385281 0.856972 0.172687 ] [ 0.887709 0.787351 0.562351 ] [ 0.856972 0.614719 0.172687 ] [ 0.554245 0.310174 0.575635 ] ] } "species" { "source-value" [ "Rb" "Rb" "Rb" "Rb" "V" "V" "V" "V" "V" "Cd" "Cl" "O" "O" "O" "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" 9.28674294 "source-unit" "angstrom" } "c" { "source-value" 5.78633265 "source-unit" "angstrom" } }