{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmcm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.612821 0.75 ] [ 0 0.387179 0.25 ] [ 0 0 0.5 ] [ 0 0 0 ] [ 0.5 0.955661 0.75 ] [ 0.5 0.044339 0.25 ] [ 0.5 0.708332 0.071192 ] [ 0.5 0.291668 0.928808 ] [ 0.5 0.708332 0.428808 ] [ 0.5 0.291668 0.571192 ] [ 0 0.181321 0.75 ] [ 0 0.818679 0.25 ] ] } "species" { "source-value" [ "La" "La" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Co" "Co" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.06254939 "source-unit" "angstrom" } "b" { "source-value" 7.00477559 "source-unit" "angstrom" } "c" { "source-value" 7.70471784 "source-unit" "angstrom" } }