{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.243368 0.479448 0.245277 ] [ 0.243368 0.020552 0.245277 ] [ 0.756632 0.520552 0.754723 ] [ 0.756632 0.979448 0.754723 ] [ 0.769429 0.75 0.363299 ] [ 0.230571 0.25 0.636701 ] [ 0.722188 0.25 0.432188 ] [ 0.277812 0.75 0.567812 ] [ 0.727673 0.75 0.099264 ] [ 0.272327 0.25 0.900736 ] [ 0.282507 0.25 0.03251 ] [ 0.932187 0.75 0.171767 ] [ 0.540079 0.75 0.181726 ] [ 0.755657 0.06676 0.343368 ] [ 0.755657 0.43324 0.343368 ] [ 0.108428 0.75 0.436322 ] [ 0.451462 0.25 0.487806 ] [ 0.548538 0.75 0.512194 ] [ 0.891572 0.25 0.563678 ] [ 0.244343 0.56676 0.656632 ] [ 0.244343 0.93324 0.656632 ] [ 0.459921 0.25 0.818274 ] [ 0.067813 0.25 0.828233 ] [ 0.717493 0.75 0.96749 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "Co" "Co" "P" "P" "C" "C" "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" 5.53644594 "source-unit" "angstrom" } "b" { "source-value" 6.96193297 "source-unit" "angstrom" } "c" { "source-value" 9.50697632 "source-unit" "angstrom" } "beta" { "source-value" 90.59695265 "source-unit" "degree" } }