{ "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" [ [ 0.75 0.771487 0.551234 ] [ 0.25 0.228513 0.448766 ] [ 0.25 0.728513 0.051234 ] [ 0.75 0.271487 0.948766 ] [ 0.25 0.509227 0.857338 ] [ 0.25 0.147129 0.088569 ] [ 0.25 0.009227 0.642662 ] [ 0.75 0.490773 0.142662 ] [ 0.75 0.852871 0.911431 ] [ 0.75 0.352871 0.588569 ] [ 0.25 0.647129 0.411431 ] [ 0.75 0.990773 0.357338 ] ] } "species" { "source-value" [ "Sn" "Sn" "Sn" "Sn" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.35374266 "source-unit" "angstrom" } "b" { "source-value" 8.04588538 "source-unit" "angstrom" } "c" { "source-value" 10.05593603 "source-unit" "angstrom" } }