{ "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" [ [ 0.495186 0.494452 0.017731 ] [ 0.977726 0.997716 0.990557 ] [ 0.836529 0.599759 0.675977 ] [ 0.627066 0.895044 0.327102 ] [ 0.350637 0.122026 0.657337 ] [ 0.174129 0.362206 0.345152 ] [ 0.584203 0.555379 0.296725 ] [ 0.527566 0.85408 0.092611 ] [ 0.952464 0.635964 0.906918 ] [ 0.796251 0.925857 0.703131 ] [ 0.656085 0.224779 0.485519 ] [ 0.110959 0.028065 0.280672 ] [ 0.438644 0.159802 0.895442 ] [ 0.035906 0.333044 0.10727 ] [ 0.365599 0.454839 0.709715 ] ] } "species" { "source-value" [ "La" "La" "Bi" "Bi" "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" 4.04090005 "source-unit" "angstrom" } "b" { "source-value" 7.00917197 "source-unit" "angstrom" } "c" { "source-value" 9.43336477 "source-unit" "angstrom" } "alpha" { "source-value" 96.80399907 "source-unit" "degree" } "beta" { "source-value" 101.20017336 "source-unit" "degree" } "gamma" { "source-value" 90.239575 "source-unit" "degree" } }