{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmmm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.178701 0 ] [ 0 0.821299 0 ] [ 0.5 0.678701 0 ] [ 0.5 0.321299 0 ] [ 0.5 0 0.5 ] [ 0 0.5 0.5 ] [ 0.5 0.203949 0.5 ] [ 0.5 0.070665 0 ] [ 0.5 0.929335 0 ] [ 0 0.928592 0.5 ] [ 0 0.071408 0.5 ] [ 0.5 0.796051 0.5 ] [ 0 0.703949 0.5 ] [ 0 0.570665 0 ] [ 0 0.429335 0 ] [ 0.5 0.428592 0.5 ] [ 0.5 0.571408 0.5 ] [ 0 0.296051 0.5 ] ] } "species" { "source-value" [ "Lu" "Lu" "Lu" "Lu" "Ni" "Ni" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.34948268976 "source-unit" "angstrom" } "b" { "source-value" 22.3776245157 "source-unit" "angstrom" } "c" { "source-value" 4.41493373 "source-unit" "angstrom" } }