{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1mn" } "basis-atom-coordinates" { "source-value" [ [ 0.125198 0.5 0.559282 ] [ 0.509024 0 0.996163 ] [ 0.009024 0.5 0.003837 ] [ 0.625198 0 0.440718 ] [ 0.989778 0 0.756343 ] [ 0.489778 0.5 0.243657 ] ] } "species" { "source-value" [ "Cu" "Cu" "Cu" "Cu" "Se" "Se" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.07181574 "source-unit" "angstrom" } "b" { "source-value" 4.13759999 "source-unit" "angstrom" } "c" { "source-value" 6.01396631 "source-unit" "angstrom" } }