{ "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 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] [ 0 0 0 ] [ 0.219305 0.314949 0.106392 ] [ 0.780695 0.685051 0.893608 ] [ 0.284996 0.83409 0.142566 ] [ 0.675361 0.635904 0.333326 ] [ 0.814012 0.138074 0.328594 ] [ 0.185988 0.861926 0.671406 ] [ 0.324639 0.364096 0.666674 ] [ 0.715004 0.16591 0.857434 ] ] } "species" { "source-value" [ "Li" "Li" "V" "V" "O" "O" "F" "F" "F" "F" "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" 4.69548448 "source-unit" "angstrom" } "b" { "source-value" 5.45006267 "source-unit" "angstrom" } "c" { "source-value" 5.67475794 "source-unit" "angstrom" } "alpha" { "source-value" 113.37433041 "source-unit" "degree" } "beta" { "source-value" 88.96350155 "source-unit" "degree" } "gamma" { "source-value" 93.3002909 "source-unit" "degree" } }