{ "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" [ [ 0.671776 0.749113 0.355017 ] [ 0.328224 0.250887 0.644983 ] [ 0.91861 0.748502 0.841743 ] [ 0.08139 0.251498 0.158257 ] [ 0.78796 0.890258 0.079703 ] [ 0.804477 0.003232 0.608237 ] [ 0.626848 0.255798 0.260179 ] [ 0.800723 0.490268 0.607538 ] [ 0.709711 0.390804 0.920373 ] [ 0.290289 0.609196 0.079627 ] [ 0.199277 0.509732 0.392462 ] [ 0.373152 0.744202 0.739821 ] [ 0.195523 0.996768 0.391763 ] [ 0.21204 0.109742 0.920297 ] ] } "species" { "source-value" [ "Sr" "Sr" "La" "La" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.53918035 "source-unit" "angstrom" } "b" { "source-value" 7.03879215 "source-unit" "angstrom" } "c" { "source-value" 10.11012071 "source-unit" "angstrom" } "alpha" { "source-value" 89.11183045 "source-unit" "degree" } "beta" { "source-value" 105.72872862 "source-unit" "degree" } "gamma" { "source-value" 94.58149239 "source-unit" "degree" } }