{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmcm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.098786 0.75 ] [ 0 0.901214 0.25 ] [ 0.5 0.598786 0.75 ] [ 0.5 0.401214 0.25 ] [ 0.5 0.936536 0.75 ] [ 0.5 0.063464 0.25 ] [ 0.5 0.24925 0.75 ] [ 0.5 0.75075 0.25 ] [ 0 0.436536 0.75 ] [ 0 0.563464 0.25 ] [ 0 0.74925 0.75 ] [ 0 0.25075 0.25 ] ] } "species" { "source-value" [ "Y" "Y" "Y" "Y" "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" 4.43998160807 "source-unit" "angstrom" } "b" { "source-value" 16.4444498749 "source-unit" "angstrom" } "c" { "source-value" 4.36651202 "source-unit" "angstrom" } }