{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pn2_1m" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.727653 0.511843 ] [ 0 0.272347 0.011843 ] [ 0.5 0.81144 0.02838 ] [ 0 0.18856 0.52838 ] [ 0.5 0.004072 0.132276 ] [ 0.5 0.509021 0.881381 ] [ 0 0.490979 0.381381 ] [ 0 0.995928 0.632276 ] ] } "species" { "source-value" [ "Mn" "Mn" "H" "H" "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" 2.94801488 "source-unit" "angstrom" } "b" { "source-value" 4.49643512 "source-unit" "angstrom" } "c" { "source-value" 5.36298266 "source-unit" "angstrom" } }