{ "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" [ [ 0.20913 0.976589 0.349209 ] [ 0.79087 0.023411 0.650791 ] [ 0.605616 0.445657 0.136566 ] [ 0.394384 0.554343 0.863434 ] [ 0 0 0 ] [ 0.793385 0.491924 0.45472 ] [ 0.206615 0.508076 0.545279 ] [ 0.097097 0.943484 0.121563 ] [ 0.902903 0.056516 0.878437 ] [ 0.702128 0.472207 0.330372 ] [ 0.297872 0.527793 0.669628 ] ] } "species" { "source-value" [ "Gd" "Gd" "Gd" "Gd" "B" "B" "B" "C" "C" "C" "C" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.61633676663 "source-unit" "angstrom" } "b" { "source-value" 3.66670830476 "source-unit" "angstrom" } "c" { "source-value" 12.0064886635 "source-unit" "angstrom" } "alpha" { "source-value" 92.6375607476 "source-unit" "degree" } "beta" { "source-value" 98.2964102219 "source-unit" "degree" } "gamma" { "source-value" 90.1854465182 "source-unit" "degree" } }