{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pcnb" } "basis-atom-coordinates" { "source-value" [ [ 0 0.25 0.351618 ] [ 0.5 0.25 0.851618 ] [ 0.5 0.75 0.148382 ] [ 0 0.75 0.648382 ] [ 0.757349 0.922182 0.392605 ] [ 0.257349 0.077818 0.107395 ] [ 0.742651 0.922182 0.892605 ] [ 0.242651 0.577818 0.392605 ] [ 0.242651 0.077818 0.607395 ] [ 0.757349 0.422182 0.607395 ] [ 0.742651 0.422182 0.107395 ] [ 0.257349 0.577818 0.892605 ] ] } "species" { "source-value" [ "Yb" "Yb" "Yb" "Yb" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.64182316 "source-unit" "angstrom" } "b" { "source-value" 7.27755967 "source-unit" "angstrom" } "c" { "source-value" 8.12888867 "source-unit" "angstrom" } }