{ "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" [ [ 0.109545 0.335476 0.241204 ] [ 0.890455 0.664524 0.758796 ] [ 0.38357 0.224381 0.788 ] [ 0.61643 0.775619 0.212 ] [ 0.174663 0.18336 0.858366 ] [ 0.658987 0.626399 0.347957 ] [ 0.367174 0.733059 0.07888 ] [ 0.341013 0.373601 0.652043 ] [ 0.566561 0.042911 0.31434 ] [ 0.433439 0.957089 0.68566 ] [ 0.825337 0.81664 0.141634 ] [ 0.632826 0.266941 0.92112 ] [ 0.794264 0.147295 0.473692 ] [ 0.205736 0.852705 0.526308 ] ] } "species" { "source-value" [ "Rb" "Rb" "S" "S" "O" "O" "O" "O" "O" "O" "O" "O" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.63341484943 "source-unit" "angstrom" } "b" { "source-value" 5.75800069775 "source-unit" "angstrom" } "c" { "source-value" 7.75016290333 "source-unit" "angstrom" } "alpha" { "source-value" 100.357227069 "source-unit" "degree" } "beta" { "source-value" 106.568210049 "source-unit" "degree" } "gamma" { "source-value" 93.9324669617 "source-unit" "degree" } }