{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0.616997 0.268586 0.557643 ] [ 0.383003 0.731414 0.442357 ] [ 0.178993 0.656091 0.858269 ] [ 0.821007 0.343909 0.141731 ] [ 0.16741 0.108845 0.822063 ] [ 0.83259 0.891155 0.177937 ] [ 0.258278 0.998278 0.472886 ] [ 0.935406 0.58341 0.284741 ] [ 0.657752 0.311092 0.905414 ] [ 0.365314 0.769191 0.781962 ] [ 0.342248 0.688908 0.094586 ] [ 0.741722 0.001722 0.527114 ] [ 0.962346 0.750886 0.842683 ] [ 0.064594 0.41659 0.715259 ] [ 0.037654 0.249114 0.157317 ] [ 0.634686 0.230809 0.218038 ] ] } "species" { "source-value" [ "Bi" "Bi" "P" "P" "Pb" "Pb" "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" 5.91388413678 "source-unit" "angstrom" } "b" { "source-value" 7.10144481193 "source-unit" "angstrom" } "c" { "source-value" 7.10620351276 "source-unit" "angstrom" } "alpha" { "source-value" 107.151521934 "source-unit" "degree" } "beta" { "source-value" 109.093378553 "source-unit" "degree" } "gamma" { "source-value" 101.515700718 "source-unit" "degree" } }