{ "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 ] [ 0.315785 0.234742 0.159786 ] [ 0 0 0 ] [ 0.684215 0.765258 0.840214 ] [ 0.507754 0.245562 0.910576 ] [ 0.492246 0.754438 0.089424 ] [ 0.861178 0.753543 0.529991 ] [ 0.909085 0.471812 0.212337 ] [ 0.138822 0.246457 0.470009 ] [ 0.277212 0.685679 0.442491 ] [ 0.722788 0.314321 0.557509 ] [ 0.090915 0.528188 0.787663 ] ] } "species" { "source-value" [ "Sb" "I" "I" "I" "Br" "Br" "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" 7.65410787471 "source-unit" "angstrom" } "b" { "source-value" 8.02274986124 "source-unit" "angstrom" } "c" { "source-value" 8.07151630212 "source-unit" "angstrom" } "alpha" { "source-value" 93.1143700432 "source-unit" "degree" } "beta" { "source-value" 92.4489112699 "source-unit" "degree" } "gamma" { "source-value" 101.979847649 "source-unit" "degree" } }