{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pm" } "basis-atom-coordinates" { "source-value" [ [ 0.002572 0.749512 0.999043 ] [ 0.002572 0.250488 0.999043 ] [ 0.997 0.749553 0.500201 ] [ 0.997 0.250447 0.500201 ] [ 0.501743 0.5 0.753259 ] [ 0.504677 0.5 0.249886 ] [ 0.500356 0 0.248977 ] [ 0.495294 0 0.756514 ] [ 0.111709 0.5 0.997953 ] [ 0.905101 0 0.005366 ] [ 0.878561 0.5 0.501293 ] [ 0.105824 0 0.499714 ] [ 0.258098 0.748593 0.758575 ] [ 0.258861 0.746341 0.265751 ] [ 0.739867 0.252718 0.233323 ] [ 0.740595 0.243891 0.736585 ] [ 0.740595 0.756109 0.736585 ] [ 0.739867 0.747282 0.233323 ] [ 0.258861 0.253659 0.265751 ] [ 0.258098 0.251407 0.758575 ] ] } "species" { "source-value" [ "Pb" "Pb" "Pb" "Pb" "Pb" "Pb" "Pb" "Pb" "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" 5.71856141 "source-unit" "angstrom" } "b" { "source-value" 8.43399881 "source-unit" "angstrom" } "c" { "source-value" 6.96867857 "source-unit" "angstrom" } "beta" { "source-value" 93.17514713 "source-unit" "degree" } }