{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pm" } "basis-atom-coordinates" { "source-value" [ [ 0.252018 0 0.731224 ] [ 0.997674 0 0.007195 ] [ 0.000132 0.5 0.506391 ] [ 0.750278 0 0.255947 ] [ 0.49554 0 0.503315 ] [ 0.728028 0.5 0.743621 ] [ 0.513048 0.5 0.001365 ] [ 0.252877 0.5 0.25473 ] [ 0.86619 0 0.627438 ] [ 0.878897 0.5 0.125526 ] [ 0.645076 0 0.881428 ] [ 0.370515 0 0.118601 ] [ 0.62393 0.5 0.37226 ] [ 0.372986 0.5 0.621282 ] [ 0.121195 0 0.373689 ] [ 0.131615 0.5 0.875987 ] ] } "species" { "source-value" [ "Li" "Ni" "Ni" "Ni" "Ni" "Ni" "Ni" "Ni" "O" "O" "O" "O" "O" "O" "O" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.19270712 "source-unit" "angstrom" } "b" { "source-value" 2.98097872 "source-unit" "angstrom" } "c" { "source-value" 9.89749994 "source-unit" "angstrom" } "beta" { "source-value" 99.49777294 "source-unit" "degree" } }