{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2/m" } "basis-atom-coordinates" { "source-value" [ [ 0.119458 0.5 0.322323 ] [ 0.880542 0.5 0.677677 ] [ 0.619458 0 0.322323 ] [ 0.380542 0 0.677677 ] [ 0.805506 0.5 0.133511 ] [ 0 0 0 ] [ 0.194494 0.5 0.866489 ] [ 0.305506 0 0.133511 ] [ 0.5 0.5 0 ] [ 0.694494 0 0.866489 ] [ 0.09335 0 0.639588 ] [ 0.90665 0 0.360412 ] [ 0.59335 0.5 0.639588 ] [ 0.40665 0.5 0.360412 ] ] } "species" { "source-value" [ "Ho" "Ho" "Ho" "Ho" "Al" "Al" "Al" "Al" "Al" "Al" "Si" "Si" "Si" "Si" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 10.1371609342 "source-unit" "angstrom" } "b" { "source-value" 4.03553189 "source-unit" "angstrom" } "c" { "source-value" 6.60432429405 "source-unit" "angstrom" } "beta" { "source-value" 100.822035415 "source-unit" "degree" } }