{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmnb" } "basis-atom-coordinates" { "source-value" [ [ 0.75 0.812343 0.413103 ] [ 0.25 0.187657 0.586897 ] [ 0.75 0.312343 0.086897 ] [ 0.25 0.687657 0.913103 ] [ 0.75 0.000138 0.806554 ] [ 0.25 0.999862 0.193446 ] [ 0.75 0.500138 0.693446 ] [ 0.25 0.499862 0.306554 ] ] } "species" { "source-value" [ "Ge" "Ge" "Ge" "Ge" "Pt" "Pt" "Pt" "Pt" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.73036355 "source-unit" "angstrom" } "b" { "source-value" 5.8720169 "source-unit" "angstrom" } "c" { "source-value" 6.18541712 "source-unit" "angstrom" } }