{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0.709124 0.345404 0.936634 ] [ 0.290876 0.845404 0.563366 ] [ 0.290876 0.654596 0.063366 ] [ 0.709124 0.154596 0.436634 ] [ 0.766682 0.869732 0.021528 ] [ 0.766682 0.630268 0.521528 ] [ 0.233318 0.130268 0.978472 ] [ 0.233318 0.369732 0.478472 ] [ 0.547285 0.609226 0.735328 ] [ 0.009144 0.829441 0.843988 ] [ 0.452715 0.109226 0.764672 ] [ 0.452715 0.390774 0.264672 ] [ 0.990856 0.170559 0.156012 ] [ 0.990856 0.329441 0.656012 ] [ 0.009144 0.670559 0.343988 ] [ 0.547285 0.890774 0.235328 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Ho" "Ho" "Ho" "Ho" "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" 6.20707416895 "source-unit" "angstrom" } "b" { "source-value" 6.15786001 "source-unit" "angstrom" } "c" { "source-value" 6.28394617967 "source-unit" "angstrom" } "beta" { "source-value" 119.542514209 "source-unit" "degree" } }