{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Ccmm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.368587 0.75 ] [ 0 0.631413 0.25 ] [ 0.5 0.868587 0.75 ] [ 0.5 0.131413 0.25 ] [ 0 0.822496 0.75 ] [ 0 0.177504 0.25 ] [ 0.215511 0.096274 0.75 ] [ 0.784489 0.903726 0.25 ] [ 0.215511 0.903726 0.25 ] [ 0.784489 0.096274 0.75 ] [ 0.5 0.322496 0.75 ] [ 0.5 0.677504 0.25 ] [ 0.715511 0.596274 0.75 ] [ 0.284489 0.403726 0.25 ] [ 0.715511 0.403726 0.25 ] [ 0.284489 0.596274 0.75 ] ] } "species" { "source-value" [ "Tm" "Tm" "Tm" "Tm" "Cd" "Cd" "Cd" "Cd" "Cd" "Cd" "Cd" "Cd" "Cd" "Cd" "Cd" "Cd" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.20015152105 "source-unit" "angstrom" } "b" { "source-value" 10.7608063782 "source-unit" "angstrom" } "c" { "source-value" 4.85820774 "source-unit" "angstrom" } }