{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4_1" } "basis-atom-coordinates" { "source-value" [ [ 0.851593 0.850991 0.375752 ] [ 0.149009 0.851593 0.625752 ] [ 0.850991 0.148407 0.125752 ] [ 0.148407 0.149009 0.875752 ] [ 0.659088 0.647156 0.969494 ] [ 0.352844 0.659088 0.219494 ] [ 0.647156 0.340912 0.719494 ] [ 0.340912 0.352844 0.469494 ] [ 0.649417 0.334293 0.584968 ] [ 0.665707 0.649417 0.834968 ] [ 0.334293 0.350583 0.334968 ] [ 0.350583 0.665707 0.084968 ] [ 0.846527 0.346197 0.513486 ] [ 0.653803 0.846527 0.763486 ] [ 0.346197 0.153473 0.263486 ] [ 0.153473 0.653803 0.013486 ] ] } "species" { "source-value" [ "La" "La" "La" "La" "Rh" "Rh" "Rh" "Rh" "C" "C" "C" "C" "C" "C" "C" "C" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.99129054 "source-unit" "angstrom" } "c" { "source-value" 15.4194147 "source-unit" "angstrom" } }