{ "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" [ [ 0.479866 0.51013 0.00144 ] [ 0.015531 0.652399 0.294945 ] [ 0.50532 0.826014 0.638182 ] [ 0.45753 0.149111 0.283016 ] [ 0.927874 0.996487 0.017087 ] [ 0.075889 0.243197 0.607407 ] [ 0.740078 0.852264 0.167705 ] [ 0.233379 0.338126 0.147 ] [ 0.80298 0.932638 0.519565 ] [ 0.728569 0.334462 0.152469 ] [ 0.273829 0.482851 0.491227 ] [ 0.218854 0.815826 0.112329 ] [ 0.267892 0.978778 0.453805 ] [ 0.682719 0.710896 0.837554 ] [ 0.318687 0.184156 0.780936 ] ] } "species" { "source-value" [ "La" "La" "La" "La" "Bi" "Bi" "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" 5.84895706 "source-unit" "angstrom" } "b" { "source-value" 5.85465823 "source-unit" "angstrom" } "c" { "source-value" 9.23622492 "source-unit" "angstrom" } "alpha" { "source-value" 107.93200213 "source-unit" "degree" } "beta" { "source-value" 93.52215944 "source-unit" "degree" } "gamma" { "source-value" 91.30188864 "source-unit" "degree" } }