{ "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" [ [ 0.5 0 0.5 ] [ 0 0.184559 0 ] [ 0 0.815441 0 ] [ 0 0.5 0.5 ] [ 0.5 0.684559 0 ] [ 0.5 0.315441 0 ] [ 0.5 0.127271 0.5 ] [ 0.5 0.872729 0.5 ] [ 0 0.627271 0.5 ] [ 0 0.372729 0.5 ] [ 0.5 0.217372 0.5 ] [ 0.5 0.782628 0.5 ] [ 0.5 0.090147 0 ] [ 0 0 0 ] [ 0.5 0.909853 0 ] [ 0 0.909682 0.5 ] [ 0 0.090318 0.5 ] [ 0 0.717372 0.5 ] [ 0 0.282628 0.5 ] [ 0 0.590147 0 ] [ 0.5 0.5 0 ] [ 0 0.409853 0 ] [ 0.5 0.409682 0.5 ] [ 0.5 0.590318 0.5 ] ] } "species" { "source-value" [ "La" "La" "La" "La" "La" "La" "Co" "Co" "Co" "Co" "Sn" "Sn" "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" 4.64756646277 "source-unit" "angstrom" } "b" { "source-value" 27.7738025506 "source-unit" "angstrom" } "c" { "source-value" 4.64499995 "source-unit" "angstrom" } }