{ "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 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0.206928 0 0.5 ] [ 0 0.31395 0 ] [ 0.793072 0 0.5 ] [ 0 0.68605 0 ] [ 0.706928 0.5 0.5 ] [ 0.5 0.81395 0 ] [ 0.293072 0.5 0.5 ] [ 0.5 0.18605 0 ] ] } "species" { "source-value" [ "V" "V" "Sn" "Sn" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.58078473 "source-unit" "angstrom" } "b" { "source-value" 6.61065257 "source-unit" "angstrom" } "c" { "source-value" 3.15105953 "source-unit" "angstrom" } }