{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.643113 0.25 0.28127 ] [ 0.356887 0.75 0.71873 ] [ 0.086682 0.75 0.175754 ] [ 0.913318 0.25 0.824246 ] [ 0.802023 0.024966 0.672887 ] [ 0.197977 0.524966 0.327113 ] [ 0.197977 0.975034 0.327113 ] [ 0.802023 0.475034 0.672887 ] [ 0.263372 0.25 0.866544 ] [ 0.736628 0.75 0.133456 ] ] } "species" { "source-value" [ "Pb" "Pb" "S" "S" "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" 4.56563853608 "source-unit" "angstrom" } "b" { "source-value" 5.40746201 "source-unit" "angstrom" } "c" { "source-value" 6.50796192183 "source-unit" "angstrom" } "beta" { "source-value" 106.553147695 "source-unit" "degree" } }