{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmnb" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.5326 0.803528 ] [ 0.75 0.4674 0.196472 ] [ 0.25 0.0326 0.696472 ] [ 0.75 0.9674 0.303528 ] [ 0.25 0.154066 0.068141 ] [ 0.75 0.845934 0.931859 ] [ 0.25 0.654066 0.431859 ] [ 0.75 0.345934 0.568141 ] [ 0.75 0.740622 0.607715 ] [ 0.25 0.259378 0.392285 ] [ 0.75 0.240622 0.892285 ] [ 0.25 0.759378 0.107715 ] ] } "species" { "source-value" [ "Ce" "Ce" "Ce" "Ce" "Zn" "Zn" "Zn" "Zn" "Pd" "Pd" "Pd" "Pd" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.44425409 "source-unit" "angstrom" } "b" { "source-value" 6.88537279 "source-unit" "angstrom" } "c" { "source-value" 8.05381555 "source-unit" "angstrom" } }