{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4/nmm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.5 0.315468 ] [ 0.5 0 0.439886 ] [ 0 0.5 0.560114 ] [ 0.5 0 0.684532 ] [ 0 0.5 0.810488 ] [ 0.5 0 0.935531 ] [ 0 0.5 0.064469 ] [ 0.5 0 0.189512 ] [ 0.5 0 0.808624 ] [ 0 0.5 0.936413 ] [ 0.5 0 0.063587 ] [ 0 0.5 0.191376 ] [ 0.5 0 0.319144 ] [ 0 0.5 0.43901 ] [ 0.5 0 0.56099 ] [ 0 0.5 0.680856 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Ni" "Ni" "Ni" "Ni" "O" "O" "O" "O" "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" 2.9561703 "source-unit" "angstrom" } "c" { "source-value" 16.66515472 "source-unit" "angstrom" } }