{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmcm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.891388 0.25 ] [ 0 0.108612 0.75 ] [ 0.5 0.391388 0.25 ] [ 0.5 0.608612 0.75 ] [ 0.5 0.181144 0.25 ] [ 0.5 0.818856 0.75 ] [ 0 0.681144 0.25 ] [ 0 0.318856 0.75 ] [ 0.5 0.750779 0.25 ] [ 0.5 0.042105 0.25 ] [ 0.5 0.249221 0.75 ] [ 0.5 0.957895 0.75 ] [ 0 0.250779 0.25 ] [ 0 0.542105 0.25 ] [ 0 0.749221 0.75 ] [ 0 0.457895 0.75 ] ] } "species" { "source-value" [ "Nd" "Nd" "Nd" "Nd" "Ni" "Ni" "Ni" "Ni" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.23523638312 "source-unit" "angstrom" } "b" { "source-value" 16.7897286093 "source-unit" "angstrom" } "c" { "source-value" 4.25259548 "source-unit" "angstrom" } }