{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cc" } "basis-atom-coordinates" { "source-value" [ [ 0.783469 0.793922 0.006064 ] [ 0.783469 0.206078 0.506064 ] [ 0.283469 0.293922 0.006064 ] [ 0.283469 0.706078 0.506064 ] [ 0.479282 0.805575 0.125489 ] [ 0.979282 0.694425 0.625489 ] [ 0.979282 0.305575 0.125489 ] [ 0.479282 0.194425 0.625489 ] [ 0.855939 0.601209 0.688734 ] [ 0.962531 0.910387 0.491104 ] [ 0.618778 0.066253 0.691109 ] [ 0.855939 0.398791 0.188734 ] [ 0.462531 0.589613 0.991104 ] [ 0.618778 0.933747 0.191109 ] [ 0.355939 0.101209 0.688734 ] [ 0.462531 0.410387 0.491104 ] [ 0.118778 0.566253 0.691109 ] [ 0.355939 0.898791 0.188734 ] [ 0.962531 0.089613 0.991104 ] [ 0.118778 0.433747 0.191109 ] ] } "species" { "source-value" [ "Mn" "Mn" "Mn" "Mn" "C" "C" "C" "C" "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" 8.55000931 "source-unit" "angstrom" } "b" { "source-value" 4.96236841 "source-unit" "angstrom" } "c" { "source-value" 5.62169209 "source-unit" "angstrom" } "beta" { "source-value" 109.98880392 "source-unit" "degree" } }