{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Ccce" } "basis-atom-coordinates" { "source-value" [ [ 0.664499 0.867556 0.168035 ] [ 0.335501 0.132444 0.168035 ] [ 0.164499 0.867556 0.331965 ] [ 0.335501 0.867556 0.831965 ] [ 0.164499 0.132444 0.668035 ] [ 0.664499 0.132444 0.831965 ] [ 0.835501 0.867556 0.668035 ] [ 0.835501 0.132444 0.331965 ] [ 0.164499 0.367556 0.168035 ] [ 0.835501 0.632444 0.168035 ] [ 0.664499 0.367556 0.331965 ] [ 0.835501 0.367556 0.831965 ] [ 0.664499 0.632444 0.668035 ] [ 0.164499 0.632444 0.831965 ] [ 0.335501 0.367556 0.668035 ] [ 0.335501 0.632444 0.331965 ] [ 0 0 0 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] [ 0 0.5 0.5 ] ] } "species" { "source-value" [ "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Au" "Au" "Au" "Au" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.64263092832 "source-unit" "angstrom" } "b" { "source-value" 12.0159715957 "source-unit" "angstrom" } "c" { "source-value" 6.60744178 "source-unit" "angstrom" } }