{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P1" } "basis-atom-coordinates" { "source-value" [ [ 0.601076 0.823243 0.246054 ] [ 0.264472 0.589989 0.674993 ] [ 0.018174 0.997693 0.991722 ] [ 0.615351 0.388804 0.334599 ] [ 0.249124 0.055809 0.579075 ] [ 0.085508 0.910608 0.654704 ] [ 0.195102 0.728339 0.98372 ] [ 0.660165 0.771145 0.934634 ] [ 0.056959 0.026957 0.34609 ] [ 0.381187 0.486001 0.360843 ] [ 0.492203 0.97222 0.576184 ] [ 0.826307 0.418944 0.555633 ] [ 0.735722 0.504532 0.217482 ] [ 0.502622 0.145589 0.194245 ] [ 0.319057 0.289787 0.735988 ] ] } "species" { "source-value" [ "Bi" "Bi" "Bi" "P" "P" "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" 5.56587177344 "source-unit" "angstrom" } "b" { "source-value" 6.79401347539 "source-unit" "angstrom" } "c" { "source-value" 7.06478504718 "source-unit" "angstrom" } "alpha" { "source-value" 108.077444509 "source-unit" "degree" } "beta" { "source-value" 109.244306485 "source-unit" "degree" } "gamma" { "source-value" 96.6426885513 "source-unit" "degree" } }