{ "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 0.270522 0.005762 ] [ 0 0.225858 0.333338 ] [ 0 0.278764 0.660591 ] [ 0.5 0.721236 0.160591 ] [ 0.5 0.729478 0.505762 ] [ 0.5 0.774142 0.833338 ] [ 0.5 0.452534 0.598562 ] [ 0 0.547466 0.098562 ] [ 0.5 0.430655 0.270625 ] [ 0.5 0.453833 0.933641 ] [ 0 0.569345 0.770625 ] [ 0 0.546167 0.433641 ] [ 0 0.942269 0.563148 ] [ 0 0.924942 0.228738 ] [ 0 0.968355 0.903344 ] [ 0.5 0.057731 0.063148 ] [ 0.5 0.031645 0.403344 ] [ 0.5 0.075058 0.728738 ] ] } "species" { "source-value" [ "Co" "Co" "Co" "Co" "Co" "Co" "O" "O" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.15041228 "source-unit" "angstrom" } "b" { "source-value" 4.69768347 "source-unit" "angstrom" } "c" { "source-value" 14.1507625 "source-unit" "angstrom" } }