{ "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" [ [ 0.259013 0.108298 0.260685 ] [ 0.740987 0.891702 0.739315 ] [ 0.124421 0.624834 0.499646 ] [ 0.875579 0.375166 0.500354 ] [ 0.358473 0.456003 0.954979 ] [ 0.641527 0.543997 0.045021 ] [ 0.87348 0.142136 0.426733 ] [ 0.12652 0.857864 0.573267 ] [ 0.323033 0.591493 0.861112 ] [ 0.676967 0.408507 0.138888 ] [ 0.180768 0.249267 0.984457 ] [ 0.819232 0.750733 0.015543 ] [ 0.686384 0.417975 0.574885 ] [ 0.313616 0.582025 0.425115 ] ] } "species" { "source-value" [ "Pb" "Pb" "C" "C" "C" "C" "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" 5.72882928716 "source-unit" "angstrom" } "b" { "source-value" 5.75579763894 "source-unit" "angstrom" } "c" { "source-value" 7.12721308641 "source-unit" "angstrom" } "alpha" { "source-value" 109.209382481 "source-unit" "degree" } "beta" { "source-value" 88.3602899317 "source-unit" "degree" } "gamma" { "source-value" 114.635909709 "source-unit" "degree" } }